1-(2-chloroethyl)-3-(3,4-dihydro-2H-thiochromen-4-yl)-1-nitrosourea
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1-(2-chloroethyl)-3-(3,4-dihydro-2H-thiochromen-4-yl)-1-nitrosourea
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CAS No:
33022-03-6
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Formula:
C12H14ClN3O2S
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Chemical Name:
1-(2-chloroethyl)-3-(3,4-dihydro-2H-thiochromen-4-yl)-1-nitrosourea
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Synonyms:
33022-03-6;1-(2-Chloroethyl)-1-nitroso-3-(thiochroman-4-yl)urea;Urea, 1-(2-chloroethyl)-1-nitroso-3-(thiochroman-4-yl)-;NSC 110800;BRN 1397051;NSC110800;1-(2-Chloroethyl)-3-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-nitrosourea;N-(2-Chloroethyl)-N'-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-N-nitrosourea;Urea, 1-(2-chloroethyl)-3-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-nitroso-;CHEMBL12470;NSC-110800;Urea, N-(2-chloroethyl)-N'-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-N-nitroso- (9CI);NCI60_000250;Urea,4-dihydro-2H-1-benzothiopyran-4-yl)-1-nitroso-;Urea,4-dihydro-2H-1-benzothiopyran-4-yl)-N-nitroso-;1-(2-chloro-ethyl)-1-nitroso-3-thiochroman-4-yl-urea;Urea, 1-(2-chloroethyl)-3-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-nitroso- (8CI)
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CAS No:
1-(2-chloroethyl)-3-(3,4-dihydro-2H-thiochromen-4-yl)-1-nitrosourea Basic Attributes
299.78 g/mol
299.0495256 g/mol
110800
Computed Properties
Molecular Weight:299.78
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:299.0495256
Monoisotopic Mass:299.0495256
Topological Polar Surface Area:87.1
Heavy Atom Count:19
Complexity:332
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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