200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 346665-94-9
346665-94-9 | 2-(1,3-DIOXO-1,3,3A,4,7,7A-HEXAHYDRO-2H-4,7-METHANOISOINDOL-2-YL)-4-METHY+
CAS No: 346665-94-9 Catalog No: AG01APZN MDL No:MFCD00422151
Product Description
Catalog Number:
AG01APZN
Chemical Name:
2-(1,3-DIOXO-1,3,3A,4,7,7A-HEXAHYDRO-2H-4,7-METHANOISOINDOL-2-YL)-4-METHY+
CAS Number:
346665-94-9
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD00422151
IUPAC Name:
2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-4-methylpentanoic acid
InChI:
InChI=1S/C15H19NO4/c1-7(2)5-10(15(19)20)16-13(17)11-8-3-4-9(6-8)12(11)14(16)18/h3-4,7-12H,5-6H2,1-2H3,(H,19,20)
InChI Key:
DHQLZILRNNWMGY-UHFFFAOYSA-N
SMILES:
CC(CC(N1C(=O)C2C(C1=O)C1CC2C=C1)C(=O)O)C
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.