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1260663-93-1 | 2,7-Naphthyridin-1(2H)-one, 6-chloro-
CAS No: 1260663-93-1 Catalog No: AG000QZO MDL No:MFCD18250873
Product Description
Catalog Number:
AG000QZO
Chemical Name:
2,7-Naphthyridin-1(2H)-one, 6-chloro-
CAS Number:
1260663-93-1
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD18250873
IUPAC Name:
6-chloro-2H-2,7-naphthyridin-1-one
InChI:
InChI=1S/C8H5ClN2O/c9-7-3-5-1-2-10-8(12)6(5)4-11-7/h1-4H,(H,10,12)
InChI Key:
ALJYDCYFBWNNLH-UHFFFAOYSA-N
SMILES:
Clc1ncc2c(c1)cc[nH]c2=O
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:
2
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:
1.2
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