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Home > Indoles and Oxindole > 835-18-7
835-18-7 | 3-phenyl-2,3-dihydroisoindol-1-one
CAS No: 835-18-7 Catalog No: AG00591L MDL No:
Product Description
Catalog Number:
AG00591L
Chemical Name:
3-phenyl-2,3-dihydroisoindol-1-one
CAS Number:
835-18-7
Molecular Formula:
C14H11NO
Molecular Weight:
209.2432
IUPAC Name:
3-phenyl-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C14H11NO/c16-14-12-9-5-4-8-11(12)13(15-14)10-6-2-1-3-7-10/h1-9,13H,(H,15,16)
InChI Key:
WSKBLLFHGABBEW-UHFFFAOYSA-N
SMILES:
O=C1NC(c2c1cccc2)c1ccccc1
NSC Number:
97633
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.248g/mol
Monoisotopic Mass:
209.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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