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1214332-35-0 | 2-Pyridinecarboxylic acid, 6-amino-3-bromo-, ethyl ester
CAS No: 1214332-35-0 Catalog No: AG0014TD MDL No:MFCD13182435
Product Description
Catalog Number:
AG0014TD
Chemical Name:
2-Pyridinecarboxylic acid, 6-amino-3-bromo-, ethyl ester
CAS Number:
1214332-35-0
Molecular Formula:
C8H9BrN2O2
Molecular Weight:
245.0733
MDL Number:
MFCD13182435
IUPAC Name:
ethyl 6-amino-3-bromopyridine-2-carboxylate
InChI:
InChI=1S/C8H9BrN2O2/c1-2-13-8(12)7-5(9)3-4-6(10)11-7/h3-4H,2H2,1H3,(H2,10,11)
InChI Key:
WCFSXWLYTRSYEV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(N)ccc1Br
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.985g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.076g/mol
Monoisotopic Mass:
243.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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