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2-Thiophenecarboxamide

2-Thiophenecarboxamide structure

CAS No:
5813-89-8
Formula:
C5H5NOS
Chemical Name:
2-Thiophenecarboxamide
Synonyms:
2-Thiophenecarboxamide;2-Thenamide;2-(Aminocarbonyl)thiophene;NSC 109369
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

white crystalline powder

2-Thiophenecarboxamide Basic Attributes

Molecular Weight：

127.16

Exact Mass：

127.16

BRN：

110153

EC Number：

238-028-2

NSC Number：

109369

DSSTox ID：

DTXSID60206849

HScode：

2934999090

Characteristics

PSA：

71.3

XLogP3：

1.54730

Appearance：

White to grayish Crystalline Powder or Crystals

Density：

1.302g/cm3

Melting Point：

181-183 °C

Boiling Point：

313.5ºC at 760 mmHg

Flash Point：

143.4ºC

Refractive Index：

1.603

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38-20/21/22

safety instructions：

36/37/39-26-22

RTECS Number：

XM8290000

Marks：

Xn,Xi

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

Computed Properties

Molecular Weight:127.17
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:127.00918496
Monoisotopic Mass:127.00918496
Topological Polar Surface Area:71.3
Heavy Atom Count:8
Complexity:105
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes