(R)-(+)-1-Benzyl-3-pyrrolidinol
Properties
- Molecular formula
- C11H15NO
- Molar mass
- 177.25 g/mol
- Exact mass
- 177.1154 Da
- logP
- 1.25Crippen estimate
- Polar surface area
- 23.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 2
- Stereocentres
- Rin SMILES atom order
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.6% of notifiers
Aggregated from 42 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
101930-07-8SMILES
C1CN(C[C@@H]1O)CC2=CC=CC=C2InChIKey
YQMXOIAIYXXXEE-LLVKDONJSA-NInChI
InChI=1S/C11H15NO/c13-11-6-7-12(9-11)8-10-4-2-1-3-5-10/h1-5,11,13H,6-9H2/t11-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Work with (R)-(+)-1-Benzyl-3-pyrrolidinol
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
1-Benzyl-3-hydroxypiperidine14813-01-581 % similar
(S)-1-Benzyl-3-hydroxypiperidine91599-79-081 % similar
(3R)-1-(Phenylmethyl)-3-piperidinol91599-81-481 % similar
1-Benzylpiperidin-4-ol4727-72-479 % similar
1-Benzyl-3-piperidinol hydrochloride105973-51-174 % similar
N-Benzyl-3-hydroxyazetidine54881-13-972 % similar
1-Benzylpyrrolidin-3-yl-methanol5731-17-960 % similar
(3S)-(+)-1-Benzyl-3-aminopyrrolidine114715-38-759 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.