2-Chlorothiobenzamide
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2-Chlorothiobenzamide
structure -
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CAS No:
15717-17-6
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Formula:
C7H6ClNS
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Chemical Name:
2-Chlorothiobenzamide
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Synonyms:
2-Chlorobenzenecarbothioamide;Benzamide, o-chlorothio-;Benzenecarbothioamide, 2-chloro-;2-CHLOROBENZENE-1-CARBOTHIOAMIDE;2-CHLOROTHIOBENZAMIDE;2-Chlorobenzothioamide;o-Chlorothiobenzamide;2-Chlorothiobenzamide,98%
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CAS No:
Characteristics
58.1
2.67450
yellow powder
1.341±0.06 g/cm3(Predicted)
62-65 °C
285.0±42.0 °C(Predicted)
126.2ºC
1.661
0.00287mmHg at 25°C
Safety Information
III
6.1
UN2811
36/37/38-20/22-43-36-22
37/39-26-36/37
Xn,Xi
Irritant
P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:171.65
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:170.9909481
Monoisotopic Mass:170.9909481
Topological Polar Surface Area:58.1
Heavy Atom Count:10
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes