200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 19819-64-8
19819-64-8 | 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-(2-phenylbutyl)-
CAS No: 19819-64-8 Catalog No: AG002BC3 MDL No:
Product Description
Catalog Number:
AG002BC3
Chemical Name:
4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-(2-phenylbutyl)-
CAS Number:
19819-64-8
Molecular Formula:
C18H21NO3
Molecular Weight:
299.3642
IUPAC Name:
2-(2-phenylbutyl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
InChI:
InChI=1S/C18H21NO3/c1-2-11(12-6-4-3-5-7-12)10-19-17(20)15-13-8-9-14(22-13)16(15)18(19)21/h3-7,11,13-16H,2,8-10H2,1H3
InChI Key:
SJEFCEHIWLILFR-UHFFFAOYSA-N
SMILES:
CCC(c1ccccc1)CN1C(=O)C2C(C1=O)C1OC2CC1
NSC Number:
35290
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.152g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.37g/mol
Monoisotopic Mass:
299.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.