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Home > Quinoline > 115787-46-7
115787-46-7 | 5(6H)-Isoquinolinone, 7,8-dihydro-, oxime
CAS No: 115787-46-7 Catalog No: AG000GVM MDL No:
Product Description
Catalog Number:
AG000GVM
Chemical Name:
5(6H)-Isoquinolinone, 7,8-dihydro-, oxime
CAS Number:
115787-46-7
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
IUPAC Name:
N-(7,8-dihydro-6H-isoquinolin-5-ylidene)hydroxylamine
InChI:
InChI=1S/C9H10N2O/c12-11-9-3-1-2-7-6-10-5-4-8(7)9/h4-6,12H,1-3H2
InChI Key:
ODZAZPZPVLNASI-UHFFFAOYSA-N
SMILES:
ON=C1CCCc2c1ccnc2
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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