200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 114092-94-3
114092-94-3 | 3H-Indole, 3-methyl-3-[(4-nitrophenyl)methyl]-
CAS No: 114092-94-3 Catalog No: AG000AJL MDL No:
Product Description
Catalog Number:
AG000AJL
Chemical Name:
3H-Indole, 3-methyl-3-[(4-nitrophenyl)methyl]-
CAS Number:
114092-94-3
Molecular Formula:
C16H14N2O2
Molecular Weight:
266.2946
IUPAC Name:
3-methyl-3-[(4-nitrophenyl)methyl]indole
InChI:
InChI=1S/C16H14N2O2/c1-16(11-17-15-5-3-2-4-14(15)16)10-12-6-8-13(9-7-12)18(19)20/h2-9,11H,10H2,1H3
InChI Key:
QTAOSJWCKYGYLL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)CC1(C)C=Nc2c1cccc2
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.106g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.3g/mol
Monoisotopic Mass:
266.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.