Monobutyl phthalate 邻苯二甲酸单丁酯

CAS 131-70-4 MFCD00043498

化学结构图

131-70-4
SMILES: CCCCOC(=O)c1ccccc1C(=O)O

化学属性

Mol. FormulaC12H14O4
Mol. Weight222.24
Melting Point73°C
Density1.173

别名和识别编码

Chemical NameMonobutyl phthalate
CAS Number131-70-4
Synonym 1,2-Benzenedicarboxylic Acid 1-Butyl Ester 1,2-Benzenedicarboxylic acid, monobutyl ester 1,2-Benzenedicarboxylicacid,monobutylester 2-(Butoxycarbonyl)benzoic acid BUTYL HYDROGEN PHTHALATE Butyl Hydrogen Phthalate Butyl hydrogen phthalate MBP MBP Phthalic acid butyl ester mono-n-Butyl phthalate MONOBUTYL PHTHALATE MnBP Mono-n-butyl Phthalate Mono-n-butyl phthalate Monobutyl phthalate {Chemicalbook} Monobutyl phthalate (mBP) N-BUTYL HYDROGEN PHTHALATE NSC 8479 PHTHALIC ACID MONO-N-BUTYL ESTER PHTHALIC ACID MONOBUTYL ESTER Phthalic Acid Butyl Ester Phthalic acid 1-hydrogen 2-butyl ester Phthalic acid 2-butyl ester Phthalic acid butyl ester Phthalic acid hydrogen 1-butyl {Chemic
MDL NumberMFCD00043498
Reaxys-RN2051402
PubChem Substance ID8575
Beilstein Registry Number2051402
EC Number205-036-2
Chemical Name Translation邻苯二甲酸单丁酯
Wiswesser Line NotationQVR BVO4
LabNetwork Molecule IDLN01099157
InChIInChI=1S/C12H14O4/c1-2-3-8-16-12(15)10-7-5-4-6-9(10)11(13)14/h4-7H,2-3,8H2,1H3,(H,13,14)
Canonical SMILESO=C(O)C1=CC=CC=C1C(OCCCC)=O
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分类

  • Aromatics
  • Metabolites & Impurities
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carboxylic acid; ester; 1fragment

产品应用

  • Di-n-Butylphthalate (DBP) metabolite.

相关文献及参考

  • Shen, O., et al.: Toxicol. Lett., 191, 9 (2009),
  • Aylward, L., et al.: Reg. Toxicol. Pharmacol., 55, 259 (2009),
  • Short: IV/18B Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/18B Year: 2001 Keyword: organic compounds; viscosity; liquids; mixtures Internet Resource: DOI:10.1007/b68240 RefComment: VII, 409 pages.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

RTECSTI2475000
Storage condition 0-10 0-10°C 2-8°C Refrigerator 储存温度2-8℃
Signal word Danger
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H360 May damage fertility or the unborn child 可能对生育能力或未出生婴儿造成伤害
Precautionary statements
  • P302+P352+P332+P313+P362+P364
  • P308+P313
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • P332+P313
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
GHS Symbol
WGK Germany3
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • S53 Avoid exposure - obtain special instructions before use 避免接触,使用前获得特别指示说明;
Hazard Codes T
Personal Protective Equipment Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
Risk Statements
  • R61 May cause harm to the unborn child 可能对未出生的婴儿导致伤害
  • R62 Possible risk of impaired fertility 有削弱生殖能力的危险
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CHDDAT Comptes Rendus des Seances de l'Academie des Sciences, Serie D:
   Sciences Naturelles.  (Paris, France)  V.262-291, 1966-80.  For publisher
   information, see CRASEV.  Volume(issue)/page/year: 273,2165,1971

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 40 gm/kg
SEX/DURATION            : female 15-18 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
   JPDSA3 Journal of Pediatric Surgery.  (Grune and Stratton, Inc., Journal
   Subscription Dept., POB 6280, Duluth, MN 55806)  V.1-

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 2250 mg/kg
SEX/DURATION            : female 10-12 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - pre-implantation mortality (e.g. reduction in
   number of implants per female; total number of implants per corpora lutea)
   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 :
   AECTCV Archives of Environmental Contamination and Toxicology.
   (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ
   070944)  V.1-    1973-  Volume(issue)/page/year: 31,170,1996

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 4500 mg/kg
SEX/DURATION            : female 7-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - craniofacial
   (including nose and tongue)
   Reproductive - Specific Developmental Abnormalities - other developmental
   abnormalities
REFERENCE :
   TOLED5 Toxicology Letters.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1977-  Volume(issue)/page/year: 78,101,1995

其他信息

  • Sigma Aldrich:131-70-4(sigmaaldrich)
  • MOL 文件:131-70-4.mol
  • 下游产品:邻苯二甲酸丁酯丁氧羰基甲酯 --> 邻苯二甲酸丁苄酯
  • TCI Shanghai:邻苯二甲酸单丁酯 Monobutyl Phthalate,>;90.0%(GC)(131-70-4)
  • 邻苯二甲酸单丁酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P1132 邻苯二甲酸单丁酯 Monobutyl Phthalate 5G 580元 2014/06/02 P1132 邻苯二甲酸单丁酯 Monobutyl Phthalate 25G 1680元

系列性分类


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