L-Seryl ethyl ester hydrochloride

C₅H₁₂ClNO₃CAS 26348-61-8169.61 g/mol

Open in Covalent MOL file

Alcohol Ester Primary amine

Properties

Molecular formula: C₅H₁₂ClNO₃
Molar mass: 169.61 g/mol
Exact mass: 169.0506 Da
Melting point: 130 °C
logP: -0.71Crippen estimate
Polar surface area: 72.5 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3
Stereocentres: Sin 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

26348-61-8

SMILES

CCOC(=O)[C@@H](N)CO.Cl

InChIKey

JZJQCLZQSHLSFB-WCCKRBBISA-N

InChI

InChI=1S/C5H11NO3.ClH/c1-2-9-5(8)4(6)3-7;/h4,7H,2-3,6H2,1H3;1H/t4-;/m0./s1

Weigh it out

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

Names and synonyms

6 names

L-Serine, ethyl ester, hydrochloride (1:1)
Serine, ethyl ester, hydrochloride, L-
L-Serine, ethyl ester, hydrochloride
Serine, ethyl ester, hydrochloride
Ethyl L-serinate hydrochloride
Ethyl serinate hydrochloride

Work with L-Seryl ethyl ester 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

Similar compounds

L-Norvaline, ethyl ester, hydrochloride (1:1)40918-51-266 % similar Ethyl cysteinate hydrochloride868-59-766 % similar Methyl DL-serinate hydrochloride5619-04-565 % similar Serine methyl ester hydrochloride5680-80-865 % similar Methyl D-serinate hydrochloride5874-57-765 % similar L-Aspartic acid diethyl ester hydrochloride16115-68-764 % similar Leucine ethyl ester hydrochloride2743-40-064 % similar Diethyl aminomalonate hydrochloride13433-00-661 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Methyl (S)-2-amino-3-hydroxy-2-methylpropanoate hydrochloride114396-63-3 Methyl L-threoninate hydrochloride39994-75-7

Elsewhere

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