Name: Name:3-(1,3-dioxo-2,3,4,5,6,7-hexahydro-1H-isoindol-2-yl)propanoic acid
Brand: Angene
SKU: AG01EM1I
Rating: 90 (10 reviews)

3-(1,3-dioxo-2,3,4,5,6,7-hexahydro-1H-isoindol-2-yl)propanoic acid

CAS No.:

98711-19-4

Catalog Number:

AG01EM1I

Molecular Formula:

C11H13NO4

Molecular Weight:

223.2252

Catalog Number:

AG01EM1I

Chemical Name:

3-(1,3-dioxo-2,3,4,5,6,7-hexahydro-1H-isoindol-2-yl)propanoic acid

CAS Number:

98711-19-4

Molecular Formula:

C11H13NO4

Molecular Weight:

223.2252

MDL Number:

MFCD31617627

IUPAC Name:

3-(1,3-dioxo-4,5,6,7-tetrahydroisoindol-2-yl)propanoic acid

InChI:

InChI=1S/C11H13NO4/c13-9(14)5-6-12-10(15)7-3-1-2-4-8(7)11(12)16/h1-6H2,(H,13,14)

InChI Key:

CGCYVQLUKFBWJT-UHFFFAOYSA-N

SMILES:

OC(=O)CCN1C(=O)C2=C(C1=O)CCCC2

Complexity:

369

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

223.084g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

223.228g/mol

Monoisotopic Mass:

223.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7