CAS 136-36-7 MFCD00020118-3-Hydroxyphenyl Benzoate 3-羟基苯基苯甲酸酯 -LabNovo

3-Hydroxyphenyl Benzoate 3-羟基苯基苯甲酸酯

CAS 136-36-7 MFCD00020118

化学结构图

SMILES: OC1=CC(=CC=C1)OC(=O)C1C=CC=CC=1

化学属性

Mol. Formula	C13H10O3
Mol. Weight	214.22
Melting Point	133-135 °C
TSCA	Yes
Boiling Point	314.35 °C at 760 mmHg

别名和识别编码

Chemical Name	3-Hydroxyphenyl Benzoate
MDL Number	MFCD00020118
CAS Number	136-36-7
Synonym	Resorcinol, monobenzoate {LY} Resorcinol, monobenzoate {} {LY} Resorcinol, monobenzoate {} {} {LY} Resorcinol, monobenzoate {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Resorcinol, monobenzoate {} {} {} {} {} {} {} {} {} {} {}
EC Number	205-241-7
PubChem Substance ID	253661435
Reaxys-RN	1873897
Chemical Name Translation	3-羟基苯基苯甲酸酯
Wiswesser Line Notation	QR COVR
Beilstein Registry Number	1873897
Canonical SMILES	C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)O

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安全信息

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；
S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
S36 Wear suitable protective clothing 穿戴适当的防护服；
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；

Risk Statements

R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
R21/22 Harmful in contact with skin and if swallowed 皮肤接触和不慎吞咽有害
R22 Harmful if swallowed 吞咽有害

WGK Germany3

GHS Symbol

Precautionary statements

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。
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+P352+P332+P313+P362+P364
P305+P351+P338+P337+P313
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 Warning

Hazard statements

H302 Harmful if swallowed 吞食有害
H315 Causes skin irritation 会刺激皮肤
H319 Causes serious eye irritation 严重刺激眼睛
H335 May cause respiratory irritation 可能导致呼吸道刺激

RTECSVH2800000

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves

Hazard Codes Xn

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   14CYAT "Industrial Hygiene and Toxicology," 2nd ed., Patty, F.A., ed., New
   York, John Wiley & Sons, Inc., 1958-63  Volume(issue)/page/year: 2,1897,1963

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : >20 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   14CYAT "Industrial Hygiene and Toxicology," 2nd ed., Patty, F.A., ed., New
   York, John Wiley & Sons, Inc., 1958-63  Volume(issue)/page/year: 2,1897,1963

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   KODAK* Kodak Company Reports.  (343 State St., Rochester, NY 14650)
   Volume(issue)/page/year: #906511

{haza

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 710 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - tremor
   Behavioral - ataxia
REFERENCE :
   JAPMA8 Journal of the American Pharmaceutical Association, Scientific
   Edition.  (Washington, DC) V.29-49, 1940-60.  For publisher information, see
   JPMSAE.  Volume(issue)/page/year: 46,185,1957

Storage condition

其他信息

图谱信息:1,3-苯二酚单苯甲酸酯 (136-36-7)质谱(MS) 1,3-苯二酚单苯甲酸酯 (136-36-7)核磁图( 13 CNMR) 1,3-苯二酚单苯甲酸酯 (136-36-7)核磁图( 1 HNMR) 1,3-苯二酚单苯甲酸酯 (136-36-7)红外图谱(IR2) 1,3-苯二酚单苯甲酸酯 (136-36-7)红外图谱(IR1) 1,3-苯二酚单苯甲酸酯 (136-36-7)Raman光谱
Alfa Aesar:间苯二酚单苯甲酸酯,94% Resorcinol monobenzoate, 94%(136-36-7)
MOL 文件:136-36-7.mol
Sigma Aldrich:136-36-7(sigmaaldrich)
TCI Shanghai:1,3-苯二酚单苯甲酸酯 Benzoic Acid 3-Hydroxyphenyl Ester,>;99.0%(GC)(136-36-7)
Acros Organics:1,3-苯二酚单苯甲酸酯 Resorcinol monobenzoate, 99%(136-36-7)