200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 866144-54-9
866144-54-9 | 4-ethyl-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)hexanoic acid
CAS No: 866144-54-9 Catalog No: AG00IZ6D MDL No:MFCD03305895
Product Description
Catalog Number:
AG00IZ6D
Chemical Name:
4-ethyl-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)hexanoic acid
CAS Number:
866144-54-9
Molecular Formula:
C16H21NO3
Molecular Weight:
275.3428
MDL Number:
MFCD03305895
IUPAC Name:
4-ethyl-3-(3-oxo-1H-isoindol-2-yl)hexanoic acid
InChI:
InChI=1S/C16H21NO3/c1-3-11(4-2)14(9-15(18)19)17-10-12-7-5-6-8-13(12)16(17)20/h5-8,11,14H,3-4,9-10H2,1-2H3,(H,18,19)
InChI Key:
ACSPQRZSBZMWMA-UHFFFAOYSA-N
SMILES:
CCC(C(N1Cc2c(C1=O)cccc2)CC(=O)O)CC
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.152g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.348g/mol
Monoisotopic Mass:
275.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.