3-CHLOROBENZYL THIOCYANATE
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3-CHLOROBENZYL THIOCYANATE
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CAS No:
64215-09-4
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Formula:
C8H6ClNS
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Chemical Name:
3-CHLOROBENZYL THIOCYANATE
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Synonyms:
3-Chlorobenzyl thiocyanate;m-chlorobenzyl thiocyanate;m-chlorobenzyl-thiocyanate;SCHEMBL6245614;CTK7D0869;(3-chlorophenyl)methyl thiocyanate;ZINC36533320;1-Chloro-3-(thiocyanatomethyl)benzene;AKOS006290553;{[(3-chlorophenyl)methyl]sulfanyl}carbonitrile
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CAS No:
Computed Properties
Molecular Weight:183.66
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:182.9909481
Monoisotopic Mass:182.9909481
Topological Polar Surface Area:49.1
Heavy Atom Count:11
Complexity:163
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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