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Home > Nitro Compounds > 1261890-28-1
1261890-28-1 | 4-(3-Nitrophenyl)picolinic acid
CAS No: 1261890-28-1 Catalog No: AG00HJCU MDL No:
Product Description
Catalog Number:
AG00HJCU
Chemical Name:
4-(3-Nitrophenyl)picolinic acid
CAS Number:
1261890-28-1
IUPAC Name:
4-(3-nitrophenyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C12H8N2O4/c15-12(16)11-7-9(4-5-13-11)8-2-1-3-10(6-8)14(17)18/h1-7H,(H,15,16)
InChI Key:
QJNYFOMIAZPCBA-UHFFFAOYSA-N
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.048g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.206g/mol
Monoisotopic Mass:
244.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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