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Benzoic acid, 3-methyl-, methyl ester

Benzoic acid, 3-methyl-, methyl ester structure

CAS No:
99-36-5
Formula:
C9H10O2
Chemical Name:
Benzoic acid, 3-methyl-, methyl ester
Synonyms:
Benzoic acid,3-methyl-,methyl ester;m-Toluic acid,methyl ester;Methyl m-toluate;Methyl 3-methylbenzoate;Methyl m-methylbenzoate;Methyl 3-toluate;NSC 20004;NSC 69227;3-Methylbenzoic acid methyl ester;Methyl 2-methyl-4-benzoate
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

clear colorless liquid

Benzoic acid, 3-methyl-, methyl ester Basic Attributes

Molecular Weight：

150.17

Exact Mass：

150.17

BRN：

2043574

EC Number：

202-753-2

NSC Number：

69227|20004

DSSTox ID：

DTXSID2059196

HScode：

2916399090

Characteristics

PSA：

26.3

XLogP3：

2.8

Appearance：

clear colorless liquid

Density：

1.0473 g/cm³ @ Temp: 40 °C

Boiling Point：

221 °C

Flash Point：

95 °C

Refractive Index：

1.509

Water Solubility：

Insoluble in water.

Safety Information

wgk germany：

hazard class code：

22-36/37/38

safety instructions：

26-37/39-36

Marks：

Xn,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 46 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

methyl 3-toluate

Benzoic acid, 3-methyl-, methyl ester Use and Manufacturing

Uses

Organic synthesis intermediate.

Manufacturing Info：

Benzoic acid, 3-methyl-, methyl ester: ACTIVE

Computed Properties

Molecular Weight:150.17
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:150.068079557
Monoisotopic Mass:150.068079557
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:143
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Benzoic acid, 3-methyl-, methyl ester

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

CN
5 YRS

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Methyl 3-methylbenzoate

CAS No.: 99-36-5

Grade: Chemical Grade

Content: 95%

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Hefei Heyu Chemical New Materials Co., Ltd Contact Supplier

CN
4 YRS

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Trader Supplier of 13-Dimethyladamantane,1-Bromo-35-dimethyladamantane,perhydroacenaphthylene,4-[1,1-bis(4-hydroxyphenyl)ethyl]phenol,CYCLOBUTANE-1,2-DICARBOXYLIC ACID DIMETHYL ESTER, TRANS

Methyl 3-methylbenzoate 99-36-5

CAS No.: 99-36-5

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Guide of Benzoic acid, 3-methyl-, methyl ester

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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Benzoic acid, 3-methyl-, methyl ester

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