Carbamic acid, (4-amino-4-thioxobutyl)-, 1,1-dimethylethyl ester (9CI)
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Carbamic acid, (4-amino-4-thioxobutyl)-, 1,1-dimethylethyl ester (9CI)
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CAS No:
156642-19-2
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Formula:
C9H18N2O2S
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Chemical Name:
Carbamic acid, (4-amino-4-thioxobutyl)-, 1,1-dimethylethyl ester (9CI)
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Synonyms:
tert-butyl N-(3-carbamothioylpropyl)carbamate;SCHEMBL18764723;CTK8H1006;ZINC39094174;AKOS011961195;Carbamic acid, (4-amino-4-thioxobutyl)-, 1,1-dimethylethyl ester (9CI);DA-17415;FT-0750396;tert-Butyl (4-amino-4-thioxobutyl)carbamate;tert-butyl N-(4-amino-4-sulfanylidenebutyl)carbamate
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CAS No:
Carbamic acid, (4-amino-4-thioxobutyl)-, 1,1-dimethylethyl ester (9CI) Basic Attributes
218.32
218.10889899
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:218.32
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:218.10889899
Monoisotopic Mass:218.10889899
Topological Polar Surface Area:96.4
Heavy Atom Count:14
Complexity:211
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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