200,000+ products from a single source!

sales@angenechem.com

Home > Indoles and Oxindole > 39830-75-6

39830-75-6

39830-75-6 | 3H-Indol-3-one, 1,2-dihydro-2-(phenylmethylene)-

CAS No: 39830-75-6 Catalog No: AG00773E MDL No:

Product Description

Catalog Number:
AG00773E
Chemical Name:
3H-Indol-3-one, 1,2-dihydro-2-(phenylmethylene)-
CAS Number:
39830-75-6
Molecular Formula:
C15H11NO
Molecular Weight:
221.2539
IUPAC Name:
2-benzylidene-1H-indol-3-one
InChI:
InChI=1S/C15H11NO/c17-15-12-8-4-5-9-13(12)16-14(15)10-11-6-2-1-3-7-11/h1-10,16H
InChI Key:
AKFPHXCDBVJHSP-UHFFFAOYSA-N
SMILES:
O=C1C(=Cc2ccccc2)Nc2c1cccc2

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.084g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.259g/mol
Monoisotopic Mass:
221.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.6  

Related Products

© 2019 Angene International Limited. All rights Reserved.