(R)-3-Phenyl-pyrrolidine hydrochloride

C10H14ClNCAS 851000-46-9183.68 g/mol

Open in Covalent MOL file
HNHCl
Secondary amine

Properties

Molecular formula
C10H14ClN
Molar mass
183.68 g/mol
Exact mass
183.0815 Da
logP
2.19Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1
Stereocentres
Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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
851000-46-9
SMILES
C1CNC[C@H]1C2=CC=CC=C2.Cl
InChIKey
DNSSGEPIODMCQR-PPHPATTJSA-N
InChI
InChI=1S/C10H13N.ClH/c1-2-4-9(5-3-1)10-6-7-11-8-10;/h1-5,10-11H,6-8H2;1H/t10-;/m0./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with (R)-3-Phenyl-pyrrolidine hydrochloride

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

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.

3-Phenylpyrrolidine936-44-7Free base, stereo not defined 3-Phenyl-pyrrolidine hydrochloride857281-02-8Stereo not defined

Similar compounds

4-Phenylpiperidine hydrochloride10272-49-878 % similar 3-Phenylpiperidine3973-62-469 % similar 4-Phenylpiperidine771-99-367 % similar Phenylcyclopropane873-49-448 % similar 2,3,4,5-Tetrahydro-1H-1,5-methanobenzo[d]azepine hydrochloride230615-52-847 % similar 2-Phenylpiperazine5271-26-145 % similar 4-(3-Trifluoromethylphenyl)piperidine hydrochloride6652-16-045 % similar (S)-3-(4-Bromophenyl)piperidine1335523-82-444 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2,3,4-Tetrahydro-1-naphthylamine hydrochloride49800-23-9 3-Chloro-2,6-diethylaniline67330-62-5 N-Ethyl-N-(2-chloroethyl)aniline92-49-9

Elsewhere

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