200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 78593-86-9
78593-86-9 | 2-Phenylhexahydro-4,7-methanoisoindoline
CAS No: 78593-86-9 Catalog No: AG00527Q MDL No:
Product Description
Catalog Number:
AG00527Q
Chemical Name:
2-Phenylhexahydro-4,7-methanoisoindoline
CAS Number:
78593-86-9
Molecular Formula:
C15H19N
Molecular Weight:
213.3181
IUPAC Name:
4-phenyl-4-azatricyclo[5.2.1.02,6]decane
InChI:
InChI=1S/C15H19N/c1-2-4-13(5-3-1)16-9-14-11-6-7-12(8-11)15(14)10-16/h1-5,11-12,14-15H,6-10H2
InChI Key:
QPAIRGGZQJJUBL-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N1CC2C(C1)C1CC2CC1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.324g/mol
Monoisotopic Mass:
213.152g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.