Home Other Building Blocks tert-butyl N-(5-cyano-4-methyl-1,3-thiazol-2-yl)carbamate

tert-butyl N-(5-cyano-4-methyl-1,3-thiazol-2-yl)carbamate

CAS No.:
1461708-14-4
Catalog Number:
AG01A67Q
Molecular Formula:
C10H13N3O2S
Molecular Weight:
239.2941
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Product Description
Catalog Number:
AG01A67Q
Chemical Name:
tert-butyl N-(5-cyano-4-methyl-1,3-thiazol-2-yl)carbamate
CAS Number:
1461708-14-4
Molecular Formula:
C10H13N3O2S
Molecular Weight:
239.2941
MDL Number:
MFCD25371737
IUPAC Name:
tert-butyl N-(5-cyano-4-methyl-1,3-thiazol-2-yl)carbamate
InChI:
InChI=1S/C10H13N3O2S/c1-6-7(5-11)16-8(12-6)13-9(14)15-10(2,3)4/h1-4H3,(H,12,13,14)
InChI Key:
XDBJYBZATRIJLN-UHFFFAOYSA-N
SMILES:
N#Cc1sc(nc1C)NC(=O)OC(C)(C)C
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.073g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.293g/mol
Monoisotopic Mass:
239.073g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties