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1198-15-8

1198-15-8 | 1-methyl-1,2,3,4-tetrahydroquinolin-4-one

CAS No: 1198-15-8 Catalog No: AG01A234 MDL No:MFCD13179363

Product Description

Catalog Number:
AG01A234
Chemical Name:
1-methyl-1,2,3,4-tetrahydroquinolin-4-one
CAS Number:
1198-15-8
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
MDL Number:
MFCD13179363
IUPAC Name:
1-methyl-2,3-dihydroquinolin-4-one
InChI:
InChI=1S/C10H11NO/c1-11-7-6-10(12)8-4-2-3-5-9(8)11/h2-5H,6-7H2,1H3
InChI Key:
PFRCTAQFFQYTKL-UHFFFAOYSA-N
SMILES:
O=C1CCN(c2c1cccc2)C

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:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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