Home Other Building Blocks Carbamic acid, N-[2-(methylthio)ethyl]-, 1,1-dimethylethyl ester

Carbamic acid, N-[2-(methylthio)ethyl]-, 1,1-dimethylethyl ester

CAS No.:
174360-08-8
Catalog Number:
AG001ZMJ
Molecular Formula:
C8H17NO2S
Molecular Weight:
191.2911
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Product Description
Catalog Number:
AG001ZMJ
Chemical Name:
Carbamic acid, N-[2-(methylthio)ethyl]-, 1,1-dimethylethyl ester
CAS Number:
174360-08-8
Molecular Formula:
C8H17NO2S
Molecular Weight:
191.2911
MDL Number:
MFCD21105444
IUPAC Name:
tert-butyl N-(2-methylsulfanylethyl)carbamate
InChI:
InChI=1S/C8H17NO2S/c1-8(2,3)11-7(10)9-5-6-12-4/h5-6H2,1-4H3,(H,9,10)
InChI Key:
WOTZPSAMFDSYKM-UHFFFAOYSA-N
SMILES:
CSCCNC(=O)OC(C)(C)C
Properties
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.098g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.289g/mol
Monoisotopic Mass:
191.098g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties