Monobenzyl phthalate 2-((苯氧基)羰基)苯甲酸

CAS 2528-16-7 MFCD00020279

化学结构图

2528-16-7
SMILES: O=C(O)c1ccccc1C(=O)OCc1ccccc1

化学属性

Mol. FormulaC15H12O4
Mol. Weight256.25
Melting Point106 °C
Boiling Point441.07 °C at 760 mmHg

别名和识别编码

Chemical Name2-((Benzyloxy)carbonyl)benzoic acid
CAS Number2528-16-7
Synonym Monobenzyl phthalate {LY} Monobenzyl phthalate mono-benzyl phthalate mono-benzyl phthalate, calcium salt phthalic acid monobenzyl ester {} {LY} Monobenzyl phthalate {} {} {LY} Monobenzyl phthalate {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Monobenzyl phthalate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Mono
MDL NumberMFCD00020279
EC Number219-771-1
Chemical Name Translation2-((苯氧基)羰基)苯甲酸
Beilstein Registry Number1884373
Reaxys-RN1884373
PubChem Substance ID31736
LabNetwork Molecule IDLN00239578
Canonical SMILESO=C(C1=CC=CC=C1C(O)=O)OCC2=CC=CC=C2
InChIInChI=1S/C15H12O4/c16-14(17)12-8-4-5-9-13(12)15(18)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)
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分类

  • Aromatics
  • Metabolites & Impurities
  • Pharmaceuticals
  • Intermediates & Fine Chemicals

产品应用

  • Phthalate metabolite, which has been shown to influence preterm deliveries.

相关文献及参考

  • Aylward, L., et al.: Reg. Toxicol. Pharmacol., 55, 259 (2009),
  • Engel, S., et al.: NeuroToxicol., 30, 522 (2009),
  • Mineno, T., et al.: Chem. Pharm. Bull., 57, 1167 (2009),
  • [1]. Meiping Tian, et al. Positive Association of Low-Level Environmental Phthalate Exposure With Sperm Motility Was Mediated by DNA Methylation: A Pilot Study. Chemosphere. 2019 Apr;220:459-467.

安全信息

RTECSCZ4322500
Storage condition 2-8°C {LY} 2-8°C Refrigerator {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C
Signal word Warning
Hazard statements
  • H319 Causes serious eye irritation 严重刺激眼睛
Precautionary statements
  • P203
  • P264+P265
  • 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。
  • P305+P351+P338
  • P318
  • P337+P317
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
GHS Symbol
WGK Germany3
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；
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 1500 mg/kg
SEX/DURATION            : female 13-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Maternal Effects - other effects
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   REPTED Reproductive Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsfor

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 1500 mg/kg
SEX/DURATION            : female 10-12 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
REFERENCE :
   REPTED Reproductive Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1987-  Volume(issue)/page/year:
   10,365,1996

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 1125 mg/kg
SEX/DURATION            : female 7-9 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Maternal Effects - other effects
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   REPTED Reproductive Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1987-  Volume(issue)/page/year:
   10,365,1996

其他信息

  • 邻苯二甲酸单苄酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 P1191 邻苯二甲酸单苄酯 Monobenzyl Phthalate 10G 1110元
  • 图谱信息:邻苯二甲酸单苄酯(2528-16-7)核磁图( 13 CNMR) 邻苯二甲酸单苄酯(2528-16-7)质谱(MS) 邻苯二甲酸单苄酯(2528-16-7)红外图谱(IR1) 邻苯二甲酸单苄酯(2528-16-7)红外图谱(IR2)
  • 邻苯二甲酸单苄酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P1191 邻苯二甲酸单苄酯 Monobenzyl Phthalate 10G 1360元
  • MOL 文件:2528-16-7.mol
  • Sigma Aldrich:2528-16-7(sigmaaldrich)
  • TCI Shanghai:邻苯二甲酸单苯甲 酯 Monobenzyl Phthalate,>;98.0%(GC)(T)(2528-16-7)

系列性分类

  1. Medical Research Areas
  2. Metabolism
  3. Endogenous Metabolite  (内源性代谢物)

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