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1235406-42-4 | Carbamic acid, N-4-thiazolyl-, 1,1-dimethylethyl ester
CAS No: 1235406-42-4 Catalog No: AG000KRG MDL No:MFCD18800853
Product Description
Catalog Number:
AG000KRG
Chemical Name:
Carbamic acid, N-4-thiazolyl-, 1,1-dimethylethyl ester
CAS Number:
1235406-42-4
Molecular Formula:
C8H12N2O2S
Molecular Weight:
200.2581
MDL Number:
MFCD18800853
IUPAC Name:
tert-butyl N-(1,3-thiazol-4-yl)carbamate
InChI:
InChI=1S/C8H12N2O2S/c1-8(2,3)12-7(11)10-6-4-13-5-9-6/h4-5H,1-3H3,(H,10,11)
InChI Key:
NNPOFSOQPYVUDW-UHFFFAOYSA-N
SMILES:
O=C(Nc1ncsc1)OC(C)(C)C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.062g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.256g/mol
Monoisotopic Mass:
200.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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