Home Halogens 6-chloro-1,5-naphthyridin-2(1H)-one

6-chloro-1,5-naphthyridin-2(1H)-one

CAS No.:
1394003-98-5
Catalog Number:
AG01DW02
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
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Product Description
Catalog Number:
AG01DW02
Chemical Name:
6-chloro-1,5-naphthyridin-2(1H)-one
CAS Number:
1394003-98-5
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD22543817
IUPAC Name:
6-chloro-1H-1,5-naphthyridin-2-one
InChI:
InChI=1S/C8H5ClN2O/c9-7-3-1-6-5(10-7)2-4-8(12)11-6/h1-4H,(H,11,12)
InChI Key:
JPPALMUZMRZGSL-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)ccc(=O)[nH]2
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:
1.3  
Properties