Piperidin-4-yl-acetic acid methyl ester hydrochloride
Properties
- Molecular formula
- C8H16ClNO2
- Molar mass
- 193.67 g/mol
- Exact mass
- 193.0870 Da
- logP
- 0.97Crippen estimate
- Polar surface area
- 38.3 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed66.7% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled33.3% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 3 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
81270-37-3SMILES
COC(=O)CC1CCNCC1.ClInChIKey
ADBDFGZYGJGDNJ-UHFFFAOYSA-NInChI
InChI=1S/C8H15NO2.ClH/c1-11-8(10)6-7-2-4-9-5-3-7;/h7,9H,2-6H2,1H3;1HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with Piperidin-4-yl-acetic acid methyl ester hydrochloride
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
Ethyl 2-(piperidin-4-yl)acetate59184-90-656 % similar
Methyl isonipecotate hydrochloride7462-86-456 % similar
Dimethyl iminodiacetate hydrochloride39987-25-255 % similar
Methyl 3-pyrrolidinecarboxylate hcl198959-37-449 % similar
Dimethyl aspartate hydrochloride32213-95-949 % similar
D-Aspartic acid dimethyl ester hydrochloride69630-50-849 % similar
(R)-Methyl pyrrolidine-3-carboxylate hydrochloride874964-22-449 % similar
Methyl sarcosinate hydrochloride13515-93-047 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.