Dodma

C41H81NO2CAS 104162-47-2620.10 g/mol

Open in Covalent MOL file
ONO
AlkeneEtherTertiary amine

Properties

Molecular formula
C41H81NO2
Molar mass
620.10 g/mol
Exact mass
619.6267 Da
logP
13.02Crippen estimate
Polar surface area
21.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
37
Double bonds
Z, ZE/Z, in SMILES order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Search the SDS library

Identifiers

CAS number
104162-47-2
SMILES
CCCCCCCC/C=C\CCCCCCCCOCC(CN(C)C)OCCCCCCCC/C=C\CCCCCCCC
InChIKey
GLGLUQVVDHRLQK-WRBBJXAJSA-N
InChI
InChI=1S/C41H81NO2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-43-40-41(39-42(3)4)44-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h19-22,41H,5-18,23-40H2,1-4H3/b21-19-,22-20-

Weigh it out

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

Work with Dodma

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

Dotma104872-42-659 % similar Polyethylene glycol monooleyl ether9004-98-248 % similar (Z)-9-Tricosene27519-02-443 % similar n-Butyl glycidyl ether2426-08-641 % similar Dlin-kc2-dma1190197-97-740 % similar Dlin-mc3-dma1224606-06-740 % similar Decyl oleate3687-46-539 % similar Dihexyl ether112-58-339 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook