chempirical

(-)-N-(α-Methylbenzyl)phthalic acid monoamide

C16H15NO3CAS 21752-36-3269.30 g/mol

Open in Covalent MOL file
NHOOOH
AlcoholCarboxylic Acid

Properties

Molecular formula
C16H15NO3
Molar mass
269.30 g/mol
Exact mass
269.1052 Da
logP
3.45Crippen estimate
Polar surface area
69.9 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
4

Identifiers

CAS number
21752-36-3
SMILES
C[C@H](N=C(O)c1ccccc1C(=O)O)c1ccccc1
InChIKey
VCFKXWGKKDZMPO-NSHDSACASA-N
InChI
InChI=1S/C16H15NO3/c1-11(12-7-3-2-4-8-12)17-15(18)13-9-5-6-10-14(13)16(19)20/h2-11H,1H3,(H,17,18)(H,19,20)/t11-/m0/s1

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Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Benzoic acid, 2-[[[(1S)-1-phenylethyl]amino]carbonyl]-
  • Phthalamic acid, N-(α-methylbenzyl)-, (S)-
  • Benzoic acid, 2-[[(1-phenylethyl)amino]carbonyl]-, (S)-
  • 2-[[[(1S)-1-Phenylethyl]amino]carbonyl]benzoic acid
  • (-)-N-(1-Phenylethyl)phthalamic acid
  • (S)-(-)-N-(α-Methylbenzyl)phthalic acid monoamide
  • (S)-N-(1-Phenylethyl)phthalamic acid
  • (S)-2-((1-Phenylethyl)carbamoyl)benzoicacid
  • 2-[[(1S)-1-Phenylethyl]carbamoyl]benzoic acid

Work with (-)-N-(α-Methylbenzyl)phthalic acid monoamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Benzoyl-L-phenylalanine2566-22-5 N-Benzoyl-dl-phenylalanine2901-76-0 4-(2-Methylbenzoylamino)-2-methylbenzoic acid317374-08-6

Elsewhere

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