(2R,4S)-N-Alpha-T-butoxycarbonyl-4-hydroxypyrrolidine-2-carboxylic acid
Properties
- Molecular formula
- C10H17NO5
- Molar mass
- 231.25 g/mol
- Exact mass
- 231.1107 Da
- logP
- 0.44Crippen estimate
- Polar surface area
- 87.1 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 1
- Stereocentres
- S, Rin SMILES atom order
Hazards
Warning
- H319 Causes serious eye irritation100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264+P265, P280, P305+P351+P338, P337+P317
Identifiers
CAS number
147266-92-0SMILES
CC(C)(C)OC(=O)N1C[C@H](C[C@@H]1C(=O)O)OInChIKey
BENKAPCDIOILGV-NKWVEPMBSA-NInChI
InChI=1S/C10H17NO5/c1-10(2,3)16-9(15)11-5-6(12)4-7(11)8(13)14/h6-7,12H,4-5H2,1-3H3,(H,13,14)/t6-,7+/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- N-Boc-4-hydroxy-D-proline, trans-
Work with (2R,4S)-N-Alpha-T-butoxycarbonyl-4-hydroxypyrrolidine-2-carboxylic acid
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.
Similar compounds
(2S,4S)-N-Boc-4-methylpyrrolidine-2-carboxylic acid364750-81-273 % similar
(2S,4S)-1-((tert-Butoxy)carbonyl)-4-fluoropyrrolidine-2-carboxylic acid203866-13-170 % similar
(2S,4R)-1-[(tert-Butoxy)carbonyl]-4-fluoropyrrolidine-2-carboxylic acid203866-14-270 % similar
(2R,4S)-1-(tert-Butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid681128-50-770 % similar
(2R,4R)-1-[(tert-Butoxy)carbonyl]-4-fluoropyrrolidine-2-carboxylic acid681128-51-870 % similar
N-Boc-cis-4-hydroxy-L-proline methyl ester102195-79-968 % similar
(2R,4R)-4-Hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester114676-69-668 % similar
1-tert-Butyl 2-methyl (2R,4S)-4-hydroxypyrrolidine-1,2-dicarboxylate135042-17-068 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.