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Methyl 2-thiophenecarboxylate

Methyl 2-thiophenecarboxylate structure

Methyl 2-thiophenecarboxylate 

structure
  • CAS No:

    5380-42-7

  • Formula:

    C6H6O2S

  • Chemical Name:

    Methyl 2-thiophenecarboxylate

  • Synonyms:

    2-Thiophenecarboxylic acid,methyl ester;Methyl 2-thiophenecarboxylate;2-(Methoxycarbonyl)thiophene;2-(Carbomethoxy)thiophene;Methyl 2-thienylcarboxylate;NSC 19879

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

Description

clear light yellow liquid


Methyl thiophene-2-carboxylate is a thiophenecarboxylic acid.

Methyl 2-thiophenecarboxylate Basic Attributes

142.18

142.18

111111

226-371-0

19879

DTXSID00202082

2934999090

Characteristics

54.5

2

clear light yellow liquid

1,23 g/cm3

82-83 °C @ Press: 8 Torr

95-97°C/15mm

1.5405-1.5435

2244 mg/L @ 25 °C (est)

Safety Information

3

24/25

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

H302

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|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:142.18
XLogP3:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:142.00885060
Monoisotopic Mass:142.00885060
Topological Polar Surface Area:54.5
Heavy Atom Count:9
Complexity:114
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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