O-Benzyl-L-serine methyl ester hydrochloride

C₁₁H₁₆ClNO₃CAS 19525-87-2245.70 g/mol

Open in Covalent MOL file

Ester Ether Primary amine

Properties

Molecular formula: C₁₁H₁₆ClNO₃
Molar mass: 245.70 g/mol
Exact mass: 245.0819 Da
logP: 1.13Crippen estimate
Polar surface area: 61.5 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 5
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

19525-87-2

SMILES

COC(=O)[C@H](COCC1=CC=CC=C1)N.Cl

InChIKey

UDHSAWHYRXHQJP-PPHPATTJSA-N

InChI

InChI=1S/C11H15NO3.ClH/c1-14-11(13)10(12)8-15-7-9-5-3-2-4-6-9;/h2-6,10H,7-8,12H2,1H3;1H/t10-;/m0./s1

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Names and synonyms

1 names

H-Ser(bzl)-ome,hcL

Work with O-Benzyl-L-serine methyl 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

Methyl (R)-phenylalaninate hydrochloride13033-84-671 % similar Phenylalanine methyl ester2577-90-463 % similar S-Benzyl-L-cysteine methyl ester hydrochloride16741-80-363 % similar O-Benzyl-L-serine4726-96-957 % similar O-(Phenylmethyl)serine5445-44-357 % similar ε-(N-Benzyloxycarbonyl)-L-lysine methyl ester hydrochloride27894-50-455 % similar D-Serine benzyl ester hydrochloride151651-44-453 % similar H-Phg-ome hcl15028-39-452 % similar

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

Same formula

D-Tyrosine, ethyl ester, hydrochloride (1:1)23234-43-7 Ethyl L-tyrosinate hydrochloride4089-07-0 α-Methyltyrosine methyl ester hydrochloride7361-31-1

Elsewhere

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