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Home > Indoles and Oxindole > 81359-40-2
81359-40-2 | Pyrido[2,1-a]isoindol-6(2H)-one, 3,4-dihydro-1-methyl-
CAS No: 81359-40-2 Catalog No: AG005L24 MDL No:
Product Description
Catalog Number:
AG005L24
Chemical Name:
Pyrido[2,1-a]isoindol-6(2H)-one, 3,4-dihydro-1-methyl-
CAS Number:
81359-40-2
Molecular Formula:
C13H13NO
Molecular Weight:
199.2484
IUPAC Name:
1-methyl-3,4-dihydro-2H-pyrido[1,2-b]isoindol-6-one
InChI:
InChI=1S/C13H13NO/c1-9-5-4-8-14-12(9)10-6-2-3-7-11(10)13(14)15/h2-3,6-7H,4-5,8H2,1H3
InChI Key:
ZPZFTQSLGMOGLP-UHFFFAOYSA-N
SMILES:
O=C1N2CCCC(=C2c2c1cccc2)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.253g/mol
Monoisotopic Mass:
199.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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