Fmoc-gamma-abu-oh

C₁₉H₁₉NO₄CAS 116821-47-7325.36 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₁₉H₁₉NO₄
Molar mass: 325.36 g/mol
Exact mass: 325.1314 Da
logP: 3.39Crippen estimate
Polar surface area: 75.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 6

Hazards

Warning

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

Identifiers

CAS number

116821-47-7

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCC(=O)O

InChIKey

ACUIFAAXWDLLTR-UHFFFAOYSA-N

InChI

InChI=1S/C19H19NO4/c21-18(22)10-5-11-20-19(23)24-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17H,5,10-12H2,(H,20,23)(H,21,22)

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Names and synonyms

1 names

4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)butanoic acid

Work with Fmoc-gamma-abu-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

Similar compounds

Fmoc-5-aminopentanoic acid123622-48-093 % similar N-Fmoc-8-aminooctanoic acid126631-93-491 % similar Fmoc-7-amino-heptanoic acid127582-76-791 % similar Fmoc-6-aminohexanoic acid88574-06-591 % similar Fmoc-B-ala-oh35737-10-188 % similar Fmoc-N-amido-peg1-acid1654740-73-477 % similar Fmoc-N-amido-peg24-acid2170484-59-875 % similar Fmoc-15-amino-4,7,10,13-tetraoxapentadecanoic acid557756-85-175 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(2S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)butanoic acid135112-27-5 (4S,5R)-3-Benzoyl-2,2-dimethyl-4-phenyloxazolidine-5-carboxylic acid153652-70-1 Fmoc-D-abu-oh170642-27-0 Fmoc-L-beta-homoalanine193954-26-6 N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-methyl-L-alanine84000-07-7 2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl]amino]-2-methylpropionic acid94744-50-0

Elsewhere

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