tert-Butyl ((1R,2S)-2-fluorocyclopropyl)carbamate

C8H14FNO2CAS 127199-16-0175.20 g/mol

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OOHNF
Alkyl halideCarbamate

Properties

Molecular formula
C8H14FNO2
Molar mass
175.20 g/mol
Exact mass
175.1009 Da
logP
1.62Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1
Stereocentres
R, 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
127199-16-0
SMILES
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1F
InChIKey
VWSDKMQGCVVQBV-NTSWFWBYSA-N
InChI
InChI=1S/C8H14FNO2/c1-8(2,3)12-7(11)10-6-4-5(6)9/h5-6H,4H2,1-3H3,(H,10,11)/t5-,6+/m0/s1

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Names and synonyms

1 names
  • Carbamic acid, (2-fluorocyclopropyl)-, 1,1-dimethylethyl ester, (1R-cis)- (9ci)

Work with tert-Butyl ((1R,2S)-2-fluorocyclopropyl)carbamate

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

Boc-D-valinol106391-87-154 % similar 3-N-Boc-amino-azetidine91188-13-553 % similar exo-3-Boc-aminotropane132234-68-553 % similar tert-Butyl (3-hydroxycyclobutyl)carbamate389890-43-153 % similar (1R,2R)-trans-N-Boc-1,2-cyclohexanediamine146504-07-653 % similar tert-Butyl N-[(1S,2S)-2-aminocyclohexyl]carbamate180683-64-153 % similar Carbamic acid, [(1S,2R)-2-aminocyclohexyl]-, 1,1-dimethylethyl ester (9ci)365996-30-153 % similar tert-Butyl 3-oxocyclobutylcarbamate154748-49-951 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

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