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Home > Pyridines > 136495-66-4
136495-66-4 | Pyrido[1,2-a]azepin-6(7H)-one, 8-methyl-
CAS No: 136495-66-4 Catalog No: AG0011X1 MDL No:
Product Description
Catalog Number:
AG0011X1
Chemical Name:
Pyrido[1,2-a]azepin-6(7H)-one, 8-methyl-
CAS Number:
136495-66-4
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
IUPAC Name:
8-methyl-7H-pyrido[1,2-a]azepin-6-one
InChI:
InChI=1S/C11H11NO/c1-9-5-6-10-4-2-3-7-12(10)11(13)8-9/h2-7H,8H2,1H3
InChI Key:
LABGKCXUVZMPKH-UHFFFAOYSA-N
SMILES:
CC1=CC=c2n(C(=O)C1)cccc2
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/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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