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920300-35-2 | 1H-Benz[e]isoindol-1-one, 2,3-dihydro-3-(2-propen-1-yl)-
CAS No: 920300-35-2 Catalog No: AG006EPU MDL No:
Product Description
Catalog Number:
AG006EPU
Chemical Name:
1H-Benz[e]isoindol-1-one, 2,3-dihydro-3-(2-propen-1-yl)-
CAS Number:
920300-35-2
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
3-prop-2-enyl-2,3-dihydrobenzo[g]isoindol-1-one
InChI:
InChI=1S/C15H13NO/c1-2-5-13-12-9-8-10-6-3-4-7-11(10)14(12)15(17)16-13/h2-4,6-9,13H,1,5H2,(H,16,17)
InChI Key:
RYCAIINQKSQVRI-UHFFFAOYSA-N
SMILES:
C=CCC1NC(=O)c2c1ccc1c2cccc1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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