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Home > Quinoline > 1823383-57-8
1823383-57-8 | 3-methyl-5,6,7,8-tetrahydroisoquinolin-8-one
CAS No: 1823383-57-8 Catalog No: AG01C04O MDL No:MFCD26521974
Product Description
Catalog Number:
AG01C04O
Chemical Name:
3-methyl-5,6,7,8-tetrahydroisoquinolin-8-one
CAS Number:
1823383-57-8
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD26521974
IUPAC Name:
3-methyl-6,7-dihydro-5H-isoquinolin-8-one
InChI:
InChI=1S/C10H11NO/c1-7-5-8-3-2-4-10(12)9(8)6-11-7/h5-6H,2-4H2,1H3
InChI Key:
RZXITJZFFTWVDM-UHFFFAOYSA-N
SMILES:
Cc1ncc2c(c1)CCCC2=O
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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