Name: Name:methyl 3-oxo-2,3-dihydro-1H-isoindole-5-carboxylate
Brand: Angene
SKU: AG01AD4X
Rating: 90 (10 reviews)

methyl 3-oxo-2,3-dihydro-1H-isoindole-5-carboxylate

CAS No.:

954239-52-2

Catalog Number:

AG01AD4X

Molecular Formula:

C10H9NO3

Molecular Weight:

191.1834

Catalog Number:

AG01AD4X

Chemical Name:

methyl 3-oxo-2,3-dihydro-1H-isoindole-5-carboxylate

CAS Number:

954239-52-2

Molecular Formula:

C10H9NO3

Molecular Weight:

191.1834

MDL Number:

MFCD09878911

IUPAC Name:

methyl 3-oxo-1,2-dihydroisoindole-5-carboxylate

InChI:

InChI=1S/C10H9NO3/c1-14-10(13)6-2-3-7-5-11-9(12)8(7)4-6/h2-4H,5H2,1H3,(H,11,12)

InChI Key:

FOUXXPLZXKYJRB-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc2c(c1)C(=O)NC2

Complexity:

264

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

191.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

191.186g/mol

Monoisotopic Mass:

191.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6