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153609-96-2

1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis- is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis-

    Cas No: 153609-96-2

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  • 153609-96-2 Structure

  • Basic information

    1. Product Name: 1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis-
    2. Synonyms: 1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis-;3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy-1(3H)-isobenzofuranone
    3. CAS NO:153609-96-2
    4. Molecular Formula: C12H16 O4
    5. Molecular Weight: 224.25
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 153609-96-2.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 444.8°C at 760 mmHg
    3. Flash Point: 175.1°C
    4. Appearance: /
    5. Density: 1.28g/cm3
    6. Vapor Pressure: 8.81E-10mmHg at 25°C
    7. Refractive Index: 1.57
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 12.44±0.40(Predicted)
    11. CAS DataBase Reference: 1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis-(CAS DataBase Reference)
    12. NIST Chemistry Reference: 1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis-(153609-96-2)
    13. EPA Substance Registry System: 1(3H)-Isobenzofuranone, 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy- , cis-(153609-96-2)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 153609-96-2(Hazardous Substances Data)

153609-96-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 153609-96-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,5,3,6,0 and 9 respectively; the second part has 2 digits, 9 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 153609-96:
(8*1)+(7*5)+(6*3)+(5*6)+(4*0)+(3*9)+(2*9)+(1*6)=142
142 % 10 = 2
So 153609-96-2 is a valid CAS Registry Number.
InChI:InChI=1/C12H16O4/c1-2-3-4-9-7-5-6-8(13)11(14)10(7)12(15)16-9/h4,8,11,13-14H,2-3,5-6H2,1H3/b9-4+

153609-96-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-ethyl-4,5-dihydroxy-1-methyl-1a,3a,4,5,6,7-hexahydrocyclopropa[c][2]benzofuran-3-one

1.2 Other means of identification

Product number -
Other names 1(3H)-Isobenzofuranone,3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy-,cis

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:153609-96-2 SDS

153609-96-2Downstream Products

153609-96-2Relevant articles and documents

Metabolism of Chuanxiong Rhizoma decoction: Identification of the metabolites in WZS-miniature pig urine

Zhang, Lei,Yang, Dong-Hui,Zhao, Xin,Xu, Feng,Liang, Jing,Zhou, Qi-Le,Yang, Xiao-Yan,Yang, Xiu-Wei

, p. 177 - 186 (2015)

Abstract Chuanxiong Rhizoma (CR), a well-known traditional Chinese medicine originated from the rhizome of Ligusticum chuanxiong Hort., was effective for treating various vascular diseases. To identify the metabolites of CR in vivo, the drug-containing urine samples of WZS-miniature pigs after orally administrated CR decoction were collected, after sequential column chromatography 17 metabolites (M1-M17) were isolated from the methanol extract of the urine samples. Their structures, including nine phthalides (M1-M9) and eight phenolic acids (M10-M17), were identified by spectroscopic means. Among them, 8 were new ones (M1-M6, M11-M12). On the basis of the structures of identified metabolites, seven original constituents, including 2 phthalides (senkyunolideI/H) and 5 phenolic acids (ferulic acid, isoferulic acid, caffeic acid, 3-hydroxycinnamoyl acid and 4-hydroxybenzonic acid) were deduced to be the major absorbed original constituents of CR in vivo. This is the first study on the metabolites of CR decoction in non-rodent animal (WZS-miniature pig), the results will give an insight into the metabolism profiles of phthalides and phenolic acids in CR decoction in vivo.

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