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1017793-59-7

1017793-59-7 | 1,6-NAPHTHYRIDINE-3-CARBOXYLIC ACID

CAS No: 1017793-59-7 Catalog No: AG0005KH MDL No:MFCD07366468

Product Description

Catalog Number:
AG0005KH
Chemical Name:
1,6-NAPHTHYRIDINE-3-CARBOXYLIC ACID
CAS Number:
1017793-59-7
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD07366468
IUPAC Name:
1,6-naphthyridine-3-carboxylic acid
InChI:
InChI=1S/C9H6N2O2/c12-9(13)7-3-6-4-10-2-1-8(6)11-5-7/h1-5H,(H,12,13)
InChI Key:
DTQIBVJDCJZFTK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1)cncc2

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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