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Home > Bromides > 1255095-03-4
1255095-03-4 | Carbamic acid, N-(2-bromo-4-methyl-5-thiazolyl)-, 1,1-dimethylethyl ester
CAS No: 1255095-03-4 Catalog No: AG000NQU MDL No:MFCD24387253
Product Description
Catalog Number:
AG000NQU
Chemical Name:
Carbamic acid, N-(2-bromo-4-methyl-5-thiazolyl)-, 1,1-dimethylethyl ester
CAS Number:
1255095-03-4
Molecular Formula:
C9H13BrN2O2S
Molecular Weight:
293.1807
MDL Number:
MFCD24387253
IUPAC Name:
tert-butyl N-(2-bromo-4-methyl-1,3-thiazol-5-yl)carbamate
InChI:
InChI=1S/C9H13BrN2O2S/c1-5-6(15-7(10)11-5)12-8(13)14-9(2,3)4/h1-4H3,(H,12,13)
InChI Key:
RIFFGJWKHWQFCV-UHFFFAOYSA-N
SMILES:
O=C(Nc1sc(nc1C)Br)OC(C)(C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.988g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.179g/mol
Monoisotopic Mass:
291.988g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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