Fmoc-D-tyr-oh

C24H21NO5CAS 112883-29-1403.43 g/mol

Open in Covalent MOL file
OONHOHOHO
CarbamateCarboxylic acidPhenol

Properties

Molecular formula
C24H21NO5
Molar mass
403.43 g/mol
Exact mass
403.1420 Da
logP
3.93Crippen estimate
Polar surface area
95.9 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
6
Stereocentres
Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
112883-29-1
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC=C(C=C4)O)C(=O)O
InChIKey
SWZCTMTWRHEBIN-JOCHJYFZSA-N
InChI
InChI=1S/C24H21NO5/c26-16-11-9-15(10-12-16)13-22(23(27)28)25-24(29)30-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22,26H,13-14H2,(H,25,29)(H,27,28)/t22-/m1/s1

Weigh it out

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Work with Fmoc-D-tyr-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.

(2S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-hydroxyphenyl)propanoic acid92954-90-0Enantiomer

Similar compounds

Fmoc-tyr-tyr-oh1269665-49-790 % similar Fmoc-phe-oh286460-71-785 % similar Fmoc-D-phenylalanine86123-10-685 % similar (S)-N-Fmoc-4-bromophenylalanine198561-04-584 % similar Fmoc-homo-L-tyrosine198560-10-082 % similar Fmoc-L-4,4'-biphenylalanine199110-64-082 % similar Fmoc-D-4-chlorophe142994-19-280 % similar Fmoc-L-4-fluorophe169243-86-180 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4S,5R)-3-Benzoyl-2-(4-methoxyphenyl)-4-phenyl-5-oxazolidinecarboxylic acid949023-16-9

Elsewhere

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