200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 26491-47-4
26491-47-4 | 1H-Isoindole-1,3(2H)-dione, hexahydro-2-phenyl-
CAS No: 26491-47-4 Catalog No: AG002TFN MDL No:
Product Description
Catalog Number:
AG002TFN
Chemical Name:
1H-Isoindole-1,3(2H)-dione, hexahydro-2-phenyl-
CAS Number:
26491-47-4
Molecular Formula:
C14H15NO2
Molecular Weight:
229.2744
IUPAC Name:
2-phenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
InChI:
InChI=1S/C14H15NO2/c16-13-11-8-4-5-9-12(11)14(17)15(13)10-6-2-1-3-7-10/h1-3,6-7,11-12H,4-5,8-9H2
InChI Key:
RVTANKMKMMBUOZ-UHFFFAOYSA-N
SMILES:
O=C1C2CCCCC2C(=O)N1c1ccccc1
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.11g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.279g/mol
Monoisotopic Mass:
229.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.