[4-[(2-chloroacetyl)amino]-3-ethyl-5-methylphenyl] thiocyanate
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[4-[(2-chloroacetyl)amino]-3-ethyl-5-methylphenyl] thiocyanate
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CAS No:
731001-91-5
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Formula:
C12H13ClN2OS
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Chemical Name:
[4-[(2-chloroacetyl)amino]-3-ethyl-5-methylphenyl] thiocyanate
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Synonyms:
2-chloro-N-[4-(cyanosulfanyl)-2-ethyl-6-methylphenyl]acetamide;731001-91-5;MLS000418053;CHEMBL1438778;HMS2547N16;[4-[(2-chloroacetyl)amino]-3-ethyl-5-methylphenyl] thiocyanate;ZINC3289455;AKOS030661733;MCULE-7297184646;NE31902;SMR000264858;EN300-08720;SR-01000047672;SR-01000047672-1
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CAS No:
[4-[(2-chloroacetyl)amino]-3-ethyl-5-methylphenyl] thiocyanate Basic Attributes
268.76 g/mol
268.0437119 g/mol
Computed Properties
Molecular Weight:268.76
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:268.0437119
Monoisotopic Mass:268.0437119
Topological Polar Surface Area:78.2
Heavy Atom Count:17
Complexity:315
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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