chempirical

Nikkol vc-ip

C70H128O10CAS 183476-82-61129.78 g/mol

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AlkeneEsterLactone

Properties

Molecular formula
C70H128O10
Molar mass
1129.78 g/mol
Exact mass
1128.9508 Da
logP
21.01Crippen estimate
Polar surface area
131.5 Ų
H-bond donors / acceptors
0 / 10
Rotatable bonds
58
Stereocentres
S, Rin SMILES atom order

Identifiers

CAS number
183476-82-6
SMILES
CCCCCCCCC(CCCCCC)C(=O)OC[C@H](OC(=O)C(CCCCCC)CCCCCCCC)[C@H]1OC(=O)C(OC(=O)C(CCCCCC)CCCCCCCC)=C1OC(=O)C(CCCCCC)CCCCCCCC
InChIKey
OEWBEINAQKIQLZ-CMRBMDBWSA-N
InChI
InChI=1S/C70H128O10/c1-9-17-25-33-37-45-50-58(49-41-29-21-13-5)66(71)76-57-62(77-67(72)59(51-42-30-22-14-6)54-46-38-34-26-18-10-2)63-64(79-68(73)60(52-43-31-23-15-7)55-47-39-35-27-19-11-3)65(70(75)78-63)80-69(74)61(53-44-32-24-16-8)56-48-40-36-28-20-12-4/h58-63H,9-57H2,1-8H3/t58?,59?,60?,61?,62-,63+/m0/s1

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

Names and synonyms

6 names
  • L-Ascorbic acid, 2,3,5,6-tetrakis(2-hexyldecanoate)
  • L-Ascorbic acid, tetrakis(2-hexyldecanoate)
  • BV-OSC
  • Vitamin C tetra-isopalmitate
  • VC-IP
  • Ascorbyl tetra-2-hexyldecanoate

Work with Nikkol vc-ip

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

Dodecylsuccinic anhydride2561-85-546 % similar Ethyl cyclohexanecarboxylate3289-28-940 % similar 1,1′-[1,4-Cyclohexanediylbis(methylene)] bis(2-ethylhexanoate)53148-32-638 % similar Ethyl cyclobutanecarboxylate14924-53-935 % similar Hexyl isobutyrate2349-07-735 % similar Ethyl 2-bromotetradecanoate14980-92-835 % similar Ethyl 2-bromooctanoate5445-29-435 % similar Eastman teg-eh94-28-035 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook