Name: Name:(2R)-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanoic acid
Brand: Angene
SKU: AG01EKR9
Rating: 90 (10 reviews)

(2R)-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanoic acid

CAS No.:

1217838-84-0

Catalog Number:

AG01EKR9

Molecular Formula:

C14H17NO3

Molecular Weight:

247.2897

Catalog Number:

AG01EKR9

Chemical Name:

(2R)-4-methyl-2-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)pentanoic acid

CAS Number:

1217838-84-0

Molecular Formula:

C14H17NO3

Molecular Weight:

247.2897

MDL Number:

MFCD31431455

IUPAC Name:

(2R)-4-methyl-2-(3-oxo-1H-isoindol-2-yl)pentanoic acid

InChI:

InChI=1S/C14H17NO3/c1-9(2)7-12(14(17)18)15-8-10-5-3-4-6-11(10)13(15)16/h3-6,9,12H,7-8H2,1-2H3,(H,17,18)/t12-/m1/s1

InChI Key:

FBKXGYIYIKDCSB-GFCCVEGCSA-N

SMILES:

CC(C[C@@H](N1Cc2c(C1=O)cccc2)C(=O)O)C

Complexity:

340

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.294g/mol

Monoisotopic Mass:

247.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3