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1201785-01-4 | 2,6-Naphthyridin-1(2H)-one, 5,6,7,8-tetrahydro-, hydrochloride (1:1)
CAS No: 1201785-01-4 Catalog No: AG000QHQ MDL No:MFCD09999259
Product Description
Catalog Number:
AG000QHQ
Chemical Name:
2,6-Naphthyridin-1(2H)-one, 5,6,7,8-tetrahydro-, hydrochloride (1:1)
CAS Number:
1201785-01-4
Molecular Formula:
C8H11ClN2O
Molecular Weight:
186.6387
MDL Number:
MFCD09999259
IUPAC Name:
5,6,7,8-tetrahydro-2H-2,6-naphthyridin-1-one;hydrochloride
InChI:
InChI=1S/C8H10N2O.ClH/c11-8-7-2-3-9-5-6(7)1-4-10-8;/h1,4,9H,2-3,5H2,(H,10,11);1H
InChI Key:
ISISPMLIIGNHIH-UHFFFAOYSA-N
SMILES:
O=c1[nH]ccc2c1CCNC2.Cl
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.056g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
186.639g/mol
Monoisotopic Mass:
186.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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