ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamate
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ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamate
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CAS No:
114210-17-2
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Formula:
C12H14N2O2S
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Chemical Name:
ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamate
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Synonyms:
NSC679235;Enamine_003644;MLS000552206;CHEMBL1486935;Ethyl 3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-ylcarbamate;HMS1404F14;HMS2160N14;HMS3324D13;ZINC501401;STK525464;AKOS000279898;MCULE-6432376270;NSC-679235;IDI1_007287;NCI60_028354;SMR000145920;SR-01000035896;SR-01000035896-1;ethyl (3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamate;ethyl 3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-ylcarbamate;ethyl N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamate;(3-Cyano-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-carbamic acid ethyl ester;114210-17-2
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CAS No:
ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamate Basic Attributes
250.32 g/mol
250.07759887 g/mol
679235
Computed Properties
Molecular Weight:250.32
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:250.07759887
Monoisotopic Mass:250.07759887
Topological Polar Surface Area:90.4
Heavy Atom Count:17
Complexity:339
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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