N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-isovaline

C20H21NO4CAS 857478-30-9339.39 g/mol

OHONHOO
CarbamateCarboxylic 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 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. Search the SDS library

Identifiers

CAS number
857478-30-9
SMILES
CC[C@@](C)(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChIKey
DZSLHAJXIQCMLR-FQEVSTJZSA-N
InChI
InChI=1S/C20H21NO4/c1-3-20(2,18(22)23)21-19(24)25-12-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11,17H,3,12H2,1-2H3,(H,21,24)(H,22,23)/t20-/m0/s1

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Names and synonyms

1 names
  • (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methylbutanoic acid

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Elsewhere