(3R)-3-Methoxypyrrolidine hydrochloride

C₅H₁₂ClNOCAS 474707-30-7137.61 g/mol

Open in Covalent MOL file

Ether Secondary amine

Properties

Molecular formula: C₅H₁₂ClNO
Molar mass: 137.61 g/mol
Exact mass: 137.0607 Da
logP: 0.42Crippen estimate
Polar surface area: 21.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1
Stereocentres: Rin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

474707-30-7

SMILES

CO[C@@H]1CCNC1.Cl

InChIKey

SQMYKVUSWPIFEQ-NUBCRITNSA-N

InChI

InChI=1S/C5H11NO.ClH/c1-7-5-2-3-6-4-5;/h5-6H,2-4H2,1H3;1H/t5-;/m1./s1

Weigh it out

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

Names and synonyms

1 names

(R)-3-Methoxy-pyrrolidine hydrochloride

Work with (3R)-3-Methoxypyrrolidine 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.

(S)-3-Methoxy-pyrrolidine hydrochloride685828-16-4Enantiomer

Similar compounds

4-Methoxypiperidine hydrochloride4045-25-475 % similar 3-Methoxyazetidine hydrochloride148644-09-167 % similar 3-Methoxypiperidine4045-29-865 % similar 4-Methoxypiperidine4045-24-363 % similar 3-Methoxy-azetidine110925-17-254 % similar (2S)-Morpholin-2-ylmethanol hydrochloride1313584-92-744 % similar 2-(Hydroxymethyl)morpholine hydrochloride144053-98-544 % similar Methyl 3-pyrrolidinecarboxylate hcl198959-37-443 % similar

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

Same formula

(3S)-3-Methylmorpholine hydrochloride1022094-03-6 (2S)-2-Methylmorpholine hydrochloride1147108-99-3 (1R,3S)-3-Aminocyclopentanol hydrochloride1279032-31-3 (1R,2S)-2-Aminocyclopentanol hydrochloride137254-03-6 1,4-Oxazepane hydrochloride178312-62-4 (Tetrahydrofuran-3-yl)methanamine hydrochloride184950-35-4 (R)-3-Hydroxypiperidine hydrocloride198976-43-1 cis-(1S,2R)-2-Aminocyclopentanol hydrochloride225791-13-9

Elsewhere

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