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5-Nitro-2-thiophenecarboxaldehyde

5-Nitro-2-thiophenecarboxaldehyde structure

CAS No:
4521-33-9
Formula:
C5H3NO3S
Chemical Name:
5-Nitro-2-thiophenecarboxaldehyde
Synonyms:
2-Thiophenecarboxaldehyde,5-nitro-;5-Nitro-2-thiophenecarboxaldehyde;2-Formyl-5-nitrothiophene;5-Nitro-2-formylthiophene;5-Nitro-2-thiophenealdehyde;5-Nitro-2-thienylcarboxaldehyde;NTA;5-Nitro-2-thienylaldehyde;2-Nitrothiophene-5-carboxaldehyde;NSC 168226;5-Nitrothiophene-2-carbaldehyde;5-Nitro-2-thienaldehyde
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Pharmaceutical Intermediates > Bulk Drug Intermediates

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5-Nitro-2-thiophenecarboxaldehyde Basic Attributes

Molecular Weight：

157.15

Exact Mass：

157.15

EC Number：

224-850-9

NSC Number：

168226

DSSTox ID：

DTXSID00196437

HScode：

2934999090

Characteristics

PSA：

91.1

XLogP3：

1.6

Appearance：

Pale-yellow solid

Density：

1.5±0.1 g/cm3

Melting Point：

77.0-77.5 °C @ Solvent: Ligroine

Boiling Point：

118-120 °C @ Press: 3-4 Torr

Flash Point：

133.5±23.2 °C

Refractive Index：

1.663

Water Solubility：

Insoluble in water.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S26

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

5-nitrothiophene-2-carboxaldehyde

Computed Properties

Molecular Weight:157.15
XLogP3:1.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:156.98336413
Monoisotopic Mass:156.98336413
Topological Polar Surface Area:91.1
Heavy Atom Count:10
Complexity:156
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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5-Nitrothiophene-2-carboxaldehyde

CAS No.: 4521-33-9

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Guide of 5-Nitro-2-thiophenecarboxaldehyde

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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5-Nitro-2-thiophenecarboxaldehyde

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