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Methyl 3-hydroxythiophene-2-carboxylate

Methyl 3-hydroxythiophene-2-carboxylate structure

CAS No:
5118-06-9
Formula:
C6H6O3S
Chemical Name:
Methyl 3-hydroxythiophene-2-carboxylate
Synonyms:
METHYL 3-HYDROXYTHIOPHENE-2-CARBOXYLATE;METHYL-3-HYDROXYTHIOPHENE CARBOXYLATE;METHYL 3-HYDROXY-2-THIOPHENECARBOXYLATE;3-HYDROXYTHIOPHENE-2-CARBOXYLIC ACID METHYL ESTER;Methyl 3-hydroxythiophene-2-carboxylate ,97%;3-hydro-2-thiophenca;3-Hydroxy-2-(methoxycarbonyl)thiophene;3-Hydroxy-2-thiophenecarboxylic acid Methyl ester
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

white to light yellow crystal powder

Methyl 3-hydroxythiophene-2-carboxylate Basic Attributes

Molecular Weight：

158.18

Exact Mass：

158.003769

EC Number：

1533716-785-6

DSSTox ID：

DTXSID70342368

HScode：

2934999090

Characteristics

PSA：

74.8

XLogP3：

Appearance：

white to light yellow crystal powder

Density：

1.4±0.1 g/cm3

Melting Point：

38-43 °C(lit.)

Boiling Point：

107-109°C13mm

Flash Point：

>230 °F

Refractive Index：

1.579

Water Solubility：

Slightly soluble in water.

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

22-24/25-37/39-26

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302+H312+H332

GHS Classification：

|Warning|H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:158.18
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:158.00376522
Monoisotopic Mass:158.00376522
Topological Polar Surface Area:74.8
Heavy Atom Count:10
Complexity:137
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 5118-06-9

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Guide of Methyl 3-hydroxythiophene-2-carboxylate

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Recommended Suppliers
Latest News
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Methyl 3-hydroxythiophene-2-carboxylate

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