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1378260-92-4 | 1,7-NAPHTHYRIDINE-4-CARBOXYLIC ACID
CAS No: 1378260-92-4 Catalog No: AG0013WS MDL No:MFCD20659227
Product Description
Catalog Number:
AG0013WS
Chemical Name:
1,7-NAPHTHYRIDINE-4-CARBOXYLIC ACID
CAS Number:
1378260-92-4
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD20659227
IUPAC Name:
1,7-naphthyridine-4-carboxylic acid
InChI:
InChI=1S/C9H6N2O2/c12-9(13)7-2-4-11-8-5-10-3-1-6(7)8/h1-5H,(H,12,13)
InChI Key:
FAPBYCKNGPDLPP-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc2c1ccnc2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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