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49850-62-6

49850-62-6 | 1,5-Naphthyridine-2-Carboxylic Acid

CAS No: 49850-62-6 Catalog No: AG0038PA MDL No:MFCD06801138

Product Description

Catalog Number:
AG0038PA
Chemical Name:
1,5-Naphthyridine-2-Carboxylic Acid
CAS Number:
49850-62-6
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD06801138
IUPAC Name:
1,5-naphthyridine-2-carboxylic acid
InChI:
InChI=1S/C9H6N2O2/c12-9(13)8-4-3-6-7(11-8)2-1-5-10-6/h1-5H,(H,12,13)
InChI Key:
XCFUFRWRMISKRZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(n1)cccn2

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:
1.1  

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