Ascorbyl palmitate

C₂₂H₃₈O₇CAS 137-66-6414.54 g/mol

Open in Covalent MOL file

Alcohol Alkene Ester Lactone

Properties

Molecular formula: C₂₂H₃₈O₇
Molar mass: 414.54 g/mol
Exact mass: 414.2618 Da
Melting point: 116 °C
Water solubility: slightly soluble
logP: 4.62Crippen estimate
Polar surface area: 113.3 Å²
H-bond donors / acceptors: 3 / 7
Rotatable bonds: 17
Stereocentres: S, Rin SMILES atom order

Hazards

Warning

H319 Causes serious eye irritation36.6% of notifiers
H412 Harmful to aquatic life with long lasting effects34.1% of notifiers

Aggregated from 475 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P273, P280, P305+P351+P338, P337+P317, P501

Identifiers

CAS number

137-66-6

SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](O)[C@H]1OC(=O)C(O)=C1O

InChIKey

QAQJMLQRFWZOBN-LAUBAEHRSA-N

InChI

InChI=1S/C22H38O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(24)28-16-17(23)21-19(25)20(26)22(27)29-21/h17,21,23,25-26H,2-16H2,1H3/t17-,21+/m0/s1

Weigh it out

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

Names and synonyms

29 names · show all

L-Ascorbic acid, 6-hexadecanoate
L-Ascorbic acid, 6-palmitate
Palmitic acid, 6-ester with ascorbic acid
Palmitoyl L-ascorbic acid
Ascorbylpalmitic acid
L-Ascorbyl palmitate
Ascorbyl monopalmitate
6-Monopalmitoyl-L-ascorbate
Ascorbic palmitate
6-O-Palmitoylascorbic acid
6-Palmitoylascorbic acid
Ascorbic acid palmitate
Cetyl ascorbate
Ondascora
Quicifal
L-Ascorbyl 6-palmitate
6-Hexadecanoyl-L-ascorbic acid
L-Ascorbyl monopalmitate
Ascorbyl 6-palmitate
Ascorboyl palmitate
Ascorbic acid 6-palmitate
6-Palmitate-L-ascorbic acid
6-O-Palmitoyl-L-ascorbic acid
NSC 402451
VCP 10
E 304
Vcpal
Grindox 562
AP

Work with Ascorbyl palmitate

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

Sorbitan monolaurate1338-39-253 % similar Sorbitan monostearate1338-41-653 % similar Span 4026266-57-953 % similar Chemistry of ascorbic acid50-81-752 % similar Erythorbic acid89-65-652 % similar Propylene glycol monostearate1323-39-351 % similar Sorbitan trioctadecanoate26658-19-550 % similar Axona538-23-850 % similar

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

Elsewhere

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