Z-Phg-oh

C16H15NO4CAS 53990-33-3285.30 g/mol

Open in Covalent MOL file
OOHNOHO
CarbamateCarboxylic acid

Properties

Molecular formula
C16H15NO4
Molar mass
285.30 g/mol
Exact mass
285.1001 Da
logP
2.74Crippen estimate
Polar surface area
75.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
53990-33-3
SMILES
C1=CC=C(C=C1)COC(=O)N[C@@H](C2=CC=CC=C2)C(=O)O
InChIKey
RLDJWBVOZVJJOS-AWEZNQCLSA-N
InChI
InChI=1S/C16H15NO4/c18-15(19)14(13-9-5-2-6-10-13)17-16(20)21-11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H,17,20)(H,18,19)/t14-/m0/s1

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Work with Z-Phg-oh

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(R)-(((Phenylmethoxy)carbonyl)amino)phenylacetic acid17609-52-8Enantiomer

Similar compounds

2-(((Benzyloxy)carbonyl)amino)-2-hydroxyacetic acid56538-57-971 % similar N-Cbz-D-alanine26607-51-269 % similar 4-(((Benzyloxy)(hydroxy)methylidene)amino)cyclohexane-1-carboxylic acid34771-04-567 % similar N-Cbz-D-serine6081-61-467 % similar Cbz-D-valine1685-33-266 % similar Fmoc-L-phenylglycine102410-65-164 % similar Fmoc-D-phg-oh111524-95-964 % similar N-Carbobenzoxy-dl-aspartic acid4515-21-364 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(2R,3S)-N-Benzoyl-3-phenylisoserine132201-33-3 Coumarin 34355804-65-4 trans-3-Benzyloxy-4-methoxy-beta-nitrostyrene63909-29-5 4-Benzyloxy-3-methoxy-omega-nitrostyrene63909-38-6 Dihydroavenanthramide D697235-49-7

Elsewhere

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