2-Benzyl-4-chlorophenol 4-氯-2-苄基苯酚

CAS 120-32-1 MFCD00020140

化学结构图

120-32-1
SMILES: Oc1ccc(Cl)cc1Cc1ccccc1

化学属性

Mol. FormulaC13H11ClO
Mol. Weight218.68
Boiling Point160-162 °C at 760 mmHg
Density1.188
Melting Point46-49 °C
Flash Point185°(365°F)
TSCAYes
Solubility<0.1 G/100 ML AT 16 ºC

别名和识别编码

Chemical Name2-Benzyl-4-chlorophenol
CAS Number120-32-1
Synonym Clorofene {LY} Clorofene {} {LY} Clorofene {} {} {LY} Clorofene {} {} {} {LY} Clorofene {} {} {} {} {LY} Clorofene {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Clorofene {} {} {} {} {} {}
PubChem Substance ID87563799
EC Number 204-385-8
MDL NumberMFCD00020140
Reaxys-RN1959194
Merck Number2407
Beilstein Registry Number1959194
Chemical Name Translation4-氯-2-苄基苯酚
Wiswesser Line NotationQR DG B1R
LabNetwork Molecule IDLN00223674
Canonical SMILESOC1=CC=C(C=C1CC2=CC=CC=C2)Cl
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分类

  • {SNA} Building Blocks, C9 to C20+, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Phenols
  • Building Blocks, C9 to C20+, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Phenols

产品应用

  • Chlorophene is a pharmaceutical and personal care product used in household, hospital and veterinary disinfectant preparations.

相关文献及参考

  • Zhang, H., et al.: Environ. Sci. Technol., 42, 5548 (2008),
  • Feitosa-Felizzola, J., et al.: Environ. Poll., 157, 1317 (2009),
  • Hennebel, T., et al.: Water Res., 44, 1458 (2010),
  • Merck 14 ,2407
  • FT-IR 2 (2), 1911:C

安全信息

GHS Symbol
WGK Germany3
Hazard Codes 9
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
RTECSGO7175000
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P312+P330
  • P302+P350
  • P305+P351+P338
  • P332+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服,清洗后方可重新使用
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
UN Number 3077 UN 3077 9/PG 3 UN3077
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置;
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置;
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中,参考特别指示/安全收据说明书;
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R50/53
  • R51/53
Packing GroupIII
Storage condition 0-10 0-10°C
Hazard Class9
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 14 gm/kg/34W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Skin and Appendages - tumors
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   19,413,1959

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 87600 mg/kg/2Y-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Kidney, Ureter, Bladder - Kidney tumors
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-424,1994

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 175 gm/kg/2Y-I
TOXIC EFFECTS :
   Tumorigenic - neoplastic by RTECS criteria
   Kidney, Ureter, Bladder - Kidney tumors
REFERENCE :
   NTPTR* National Toxicology Program Technical Report Series.  (Research
   Triangle Park, NC 27709) No.206-  Volume(issue)/page/year: NTP-TR-424,1994

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1700 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPMSAE Journal of Pharmaceutical Sciences.  (American Pharmaceutical Assoc.,
   2215 Constitution Ave., NW, Washington, DC 20037)  V.50-    1961-
   Volume(issue)/page/year: 63,1068,1974

TYPE OF TEST            : LC - Lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >13200 mg/m3/6H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: OTS0520434

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 350 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   PHTXA6 Pharmacology and Toxicology.  English translation of FATOAO.  (New
   York, NY)  V.20-22, 1957-59.  Discontinued.  Volume(issue)/page/year:
   22,270,1959

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 3 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: OTS0520317

{hazard_com

TYPE OF TEST            : Mutation in mammalian somatic cells
TEST SYSTEM             : Rodent - mouse Lymphocyte
DOSE/DURATION           : 25 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 196,61,1988

TYPE OF TEST            : Mutation in mammalian somatic cells
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 40 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 196,61,1988

其他信息

  • RTECS号:GO7175000
  • NIST化学物质信息:Phenol, 4-chloro-2-benzyl-(120-32-1)
  • 图谱信息:4-氯-2-苄基苯酚(120-32-1)红外图谱(IR1) 4-氯-2-苄基苯酚(120-32-1)红外图谱(IR2) 4-氯-2-苄基苯酚(120-32-1)核磁图( 1 HNMR) 4-氯-2-苄基苯酚(120-32-1)质谱(MS) 4-氯-2-苄基苯酚(120-32-1)核磁图( 13 CNMR)
  • EPA化学物质信息:Phenol, 4-chloro-2-(phenylmethyl)- (120-32-1)
  • 用途:用作农药、医药中间体
  • 海关编码:29081000
  • 毒害物质数据:120-32-1(Hazardous Substances Data)
  • PackingGroup:III
  • HazardClass:9
  • MOL 文件:120-32-1.mol
  • 4-氯-2-苄基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0812 2-苄基-4-氯苯酚 2-Benzyl-4-chlorophenol 25G 299元 2010/06/21 SB00798DA 4-氯-2-苄基苯酚 2-benzyl-4-chlorophenol 1 GR 255元 2010/06/21 SB00798EB 4-氯-2-苄基苯酚 2-benzyl-4-chlorophenol 25 GR 390元

系列性分类