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1312760-59-0 | 1,5-Naphthyridin-4-ol, 6-chloro-
CAS No: 1312760-59-0 Catalog No: AG000VU5 MDL No:MFCD15147086
Product Description
Catalog Number:
AG000VU5
Chemical Name:
1,5-Naphthyridin-4-ol, 6-chloro-
CAS Number:
1312760-59-0
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD15147086
IUPAC Name:
6-chloro-1H-1,5-naphthyridin-4-one
InChI:
InChI=1S/C8H5ClN2O/c9-7-2-1-5-8(11-7)6(12)3-4-10-5/h1-4H,(H,10,12)
InChI Key:
QKMKGIVCGORHJY-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)c(O)ccn2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.009g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.591g/mol
Monoisotopic Mass:
180.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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