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5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde

5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde structure

CAS No:
26033-27-2
Formula:
C8H6N2OS
Chemical Name:
5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde
Synonyms:
3-(2-Thienyl)-1H-pyrazole-4-carbaldehyde; 3-thien-2-yl-1H-pyrazole-4-carbaldehyde;

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5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde Basic Attributes

Molecular Weight：

178.21100

Exact Mass：

178.02008399 g/mol

DSSTox ID：

DTXSID80353208

HScode：

2934999090

Characteristics

PSA：

73.99000

XLogP3：

1.95070

Density：

1.398g/cm3

Melting Point：

63-66ºC

Boiling Point：

429.8ºC

Flash Point：

213.7ºC

Refractive Index：

1.686

Vapor Pressure：

1.37E-07mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

Marks：

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:178.21
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:178.02008399
Monoisotopic Mass:178.02008399
Topological Polar Surface Area:74
Heavy Atom Count:12
Complexity:176
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-thiophen-2-yl-1H-pyrazole-4-carbaldehyde

Basic Attributes
Characteristics
Safety Information
Computed Properties

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