Name: Name:methyl 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate
Brand: Angene
SKU: AG01AKBR
Rating: 90 (10 reviews)

methyl 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate

CAS No.:

39739-01-0

Catalog Number:

AG01AKBR

Molecular Formula:

C12H11NO4

Molecular Weight:

233.2200

Catalog Number:

AG01AKBR

Chemical Name:

methyl 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoate

CAS Number:

39739-01-0

Molecular Formula:

C12H11NO4

Molecular Weight:

233.2200

MDL Number:

MFCD00600649

IUPAC Name:

methyl 3-(1,3-dioxoisoindol-2-yl)propanoate

InChI:

InChI=1S/C12H11NO4/c1-17-10(14)6-7-13-11(15)8-4-2-3-5-9(8)12(13)16/h2-5H,6-7H2,1H3

InChI Key:

IACYEVDEQNXLSN-UHFFFAOYSA-N

SMILES:

COC(=O)CCN1C(=O)c2c(C1=O)cccc2

NSC Number:

192712

Complexity:

328

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.223g/mol

Monoisotopic Mass:

233.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3