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Home > Bromides > 1227958-32-8
1227958-32-8 | Carbamic acid, N-(2-bromo-6-chloro-3-pyridinyl)-, 1,1-dimethylethyl ester
CAS No: 1227958-32-8 Catalog No: AG000JHD MDL No:MFCD20039978
Product Description
Catalog Number:
AG000JHD
Chemical Name:
Carbamic acid, N-(2-bromo-6-chloro-3-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number:
1227958-32-8
Molecular Formula:
C10H12BrClN2O2
Molecular Weight:
307.5715
MDL Number:
MFCD20039978
IUPAC Name:
tert-butyl N-(2-bromo-6-chloropyridin-3-yl)carbamate
InChI:
InChI=1S/C10H12BrClN2O2/c1-10(2,3)16-9(15)13-6-4-5-7(12)14-8(6)11/h4-5H,1-3H3,(H,13,15)
InChI Key:
ZFFFXKCZHWHRET-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(nc1Br)Cl)OC(C)(C)C
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.977g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.572g/mol
Monoisotopic Mass:
305.977g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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