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2-NITROTHIOPHENE-4-CARBOXALDEHYDE

2-NITROTHIOPHENE-4-CARBOXALDEHYDE structure

CAS No:
75428-45-4
Formula:
C5H3NO3S
Chemical Name:
2-NITROTHIOPHENE-4-CARBOXALDEHYDE
Synonyms:
BUTTPARK 121\04-88;5-NITROTHIOPHENE-3-CARBALDEHYDE;5-NITROTHIOPHENE-3-CARBOXALDEHYDE;2-NITROTHIOPHENE-4-CARBOXALDEHYDE;5-Nitrothiophene-3-carboxaldehyde,97%;3-Thiophenecarboxaldehyde, 5-nitro- (6CI,7CI,9CI);3-Formyl-5-nitrothiophene, 2-Nitrothiophene-4-carboxaldehyde, 4-Formyl-2-nitrothiophene;2-Nitrothiophene-4-carboxaldehyde, 4-Formyl-2-nitrothiophene
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-NITROTHIOPHENE-4-CARBOXALDEHYDE Basic Attributes

Molecular Weight：

157.15

Exact Mass：

156.98300

BRN：

1342966

DSSTox ID：

DTXSID50226354

HScode：

2934999090

Characteristics

PSA：

91.1

XLogP3：

1.99200

Density：

1.534 g/cm3

Melting Point：

79-81°C

Boiling Point：

283.3ºC at 760 mmHg

Flash Point：

125.2ºC

Refractive Index：

1.662

Safety Information

hazard class code：

36/37/38

safety instructions：

22-24/25

Precautionary statement(s)：

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

Hazard Statements：

H315

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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:157.15
XLogP3:1.2
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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Guide of 2-NITROTHIOPHENE-4-CARBOXALDEHYDE

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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2-NITROTHIOPHENE-4-CARBOXALDEHYDE

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