2-CHLOROPHENYLISOTHIOCYANATE
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2-CHLOROPHENYLISOTHIOCYANATE
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CAS No:
2740-81-0
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Formula:
C7H4ClNS
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Chemical Name:
2-CHLOROPHENYLISOTHIOCYANATE
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Synonyms:
TIMTEC-BBSBB006587;o-Chlorophenylthiocyanate;2-Chloroisothiocyanatobenzene;2-CHLOROPHENYLISOTHIOCYANATE;O-CHLOROPHENYLISOTHIOCYANATE;1-CHLORO-2-ISOTHIOCYANATO-BENZENE;2-Chlorophenylisothiocyanate,99%;2-Chlorophenylisothiocyanate,99%5GR;ISOTHIOCYANICACID2-CHLOROPHENYLESTER
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CAS No:
Characteristics
44.4
3.07430
Clear yellow Liquid
1.299
80 °C
260-2 °C
>110°C
1.6608
0.0164mmHg at 25°C
Safety Information
III
8
2810
20/21/22-36/37/38
26-36/37/39-28-27
C,T,Xn
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
H302
|Warning|H302 (95.45%): Harmful if swallowed [Warning Acute toxicity, oral]|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, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:169.63
XLogP3:3.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:168.9752980
Monoisotopic Mass:168.9752980
Topological Polar Surface Area:44.4
Heavy Atom Count:10
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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