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1245915-30-3 | Carbamic acid, N-(6-bromo-3-chloro-2-pyridinyl)-, 1,1-dimethylethyl ester
CAS No: 1245915-30-3 Catalog No: AG000MFU MDL No:MFCD18257814
Product Description
Catalog Number:
AG000MFU
Chemical Name:
Carbamic acid, N-(6-bromo-3-chloro-2-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number:
1245915-30-3
Molecular Formula:
C10H12BrClN2O2
Molecular Weight:
307.5715
MDL Number:
MFCD18257814
IUPAC Name:
tert-butyl N-(6-bromo-3-chloropyridin-2-yl)carbamate
InChI:
InChI=1S/C10H12BrClN2O2/c1-10(2,3)16-9(15)14-8-6(12)4-5-7(11)13-8/h4-5H,1-3H3,(H,13,14,15)
InChI Key:
KEICJXNNLOTZQN-UHFFFAOYSA-N
SMILES:
O=C(Nc1nc(Br)ccc1Cl)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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