Name: Name:7-Chloro-1H-1,8-naphthyridin-2-one
Brand: Angene
SKU: AG001QPT
Rating: 90 (10 reviews)

7-Chloro-1H-1,8-naphthyridin-2-one

CAS No.:

15944-34-0

Catalog Number:

AG001QPT

Molecular Formula:

C8H5ClN2O

Molecular Weight:

180.5911

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Product Description

Catalog Number:

AG001QPT

Chemical Name:

7-Chloro-1H-1,8-naphthyridin-2-one

CAS Number:

15944-34-0

Molecular Formula:

C8H5ClN2O

Molecular Weight:

180.5911

MDL Number:

MFCD17215762

IUPAC Name:

7-chloro-1H-1,8-naphthyridin-2-one

InChI:

InChI=1S/C8H5ClN2O/c9-6-3-1-5-2-4-7(12)11-8(5)10-6/h1-4H,(H,10,11,12)

InChI Key:

VOFMYNBQUTUEOS-UHFFFAOYSA-N

SMILES:

Clc1ccc2c(n1)[nH]c(=O)cc2

Properties

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.009g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.591g/mol

Monoisotopic Mass:

180.009g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Hydrogen bonding versus stacking stabilization by modified nucleobases incorporated in PNA.DNA duplexes.	Biophysical chemistry 20090401