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1228600-91-6 | 1,6-Naphthyridin-5(6H)-one, 7,8-dihydro-2-methoxy-
CAS No: 1228600-91-6 Catalog No: AG000JMZ MDL No:
Product Description
Catalog Number:
AG000JMZ
Chemical Name:
1,6-Naphthyridin-5(6H)-one, 7,8-dihydro-2-methoxy-
CAS Number:
1228600-91-6
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
IUPAC Name:
2-methoxy-7,8-dihydro-6H-1,6-naphthyridin-5-one
InChI:
InChI=1S/C9H10N2O2/c1-13-8-3-2-6-7(11-8)4-5-10-9(6)12/h2-3H,4-5H2,1H3,(H,10,12)
InChI Key:
ULDDNWLSWDLLTO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)CCNC2=O
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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