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Home > Bromides > 1214377-39-5
1214377-39-5 | 4-Pyridinecarboxylic acid, 2-bromo-3-chloro-
CAS No: 1214377-39-5 Catalog No: AG0014Y4 MDL No:MFCD13185789
Product Description
Catalog Number:
AG0014Y4
Chemical Name:
4-Pyridinecarboxylic acid, 2-bromo-3-chloro-
CAS Number:
1214377-39-5
Molecular Formula:
C6H3BrClNO2
Molecular Weight:
236.4505
MDL Number:
MFCD13185789
IUPAC Name:
2-bromo-3-chloropyridine-4-carboxylic acid
InChI:
InChI=1S/C6H3BrClNO2/c7-5-4(8)3(6(10)11)1-2-9-5/h1-2H,(H,10,11)
InChI Key:
GWSHXCWLVTUTEE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc(c1Cl)Br
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.904g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.449g/mol
Monoisotopic Mass:
234.904g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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