(2R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)pentanoic acid

C₂₀H₂₁NO₄CAS 144701-24-6339.39 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₂₀H₂₁NO₄
Molar mass: 339.39 g/mol
Exact mass: 339.1471 Da
logP: 3.78Crippen estimate
Polar surface area: 75.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 6
Stereocentres: Rin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

144701-24-6

SMILES

CCC[C@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChIKey

JBIJSEUVWWLFGV-GOSISDBHSA-N

InChI

InChI=1S/C20H21NO4/c1-2-7-18(19(22)23)21-20(24)25-12-17-15-10-5-3-8-13(15)14-9-4-6-11-16(14)17/h3-6,8-11,17-18H,2,7,12H2,1H3,(H,21,24)(H,22,23)/t18-/m1/s1

Weigh it out

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

Names and synonyms

1 names

Fmoc-D-nva-oh

Work with (2R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)pentanoic acid

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.

Fmoc-L-norvaline135112-28-6Enantiomer

Similar compounds

Fmoc-D-nle-oh112883-41-787 % similar (2S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid77284-32-387 % similar (2S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)butanoic acid135112-27-580 % similar Fmoc-D-abu-oh170642-27-080 % similar Fmoc-L-homophenylalanine132684-59-477 % similar Fmoc-D-homophenylalanine135944-09-177 % similar Fmoc-D-homophenylalanine135994-09-177 % similar Fmoc-L-glutamic acid121343-82-676 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Fmoc-5-aminopentanoic acid123622-48-0 (3R,4S)-1-Benzoyl-3-(1-ethoxyethoxy)-4-phenyl-2-azetidinone201856-53-3 Dicentrine517-66-8 Canadine522-97-4 Fmoc-L-valine68858-20-8 Fmoc-D-valine84624-17-9 N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-isovaline857478-30-9

Elsewhere

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