1,1-Dimethoxydecane

C12H26O2CAS 7779-41-1202.34 g/mol

Open in Covalent MOL file
OO
AcetalEther

Properties

Molecular formula
C12H26O2
Molar mass
202.34 g/mol
Exact mass
202.1933 Da
Density
0.83–0.852 g/mL
Boiling point
218 °C
logP
3.75Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
10

Hazards

Warning
Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 153 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P391, P501

Identifiers

CAS number
7779-41-1
SMILES
CCCCCCCCCC(OC)OC
InChIKey
NCRNCSZWOOYBQF-UHFFFAOYSA-N
InChI
InChI=1S/C12H26O2/c1-4-5-6-7-8-9-10-11-12(13-2)14-3/h12H,4-11H2,1-3H3

Weigh it out

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

Names and synonyms

4 names
  • Decane, 1,1-dimethoxy-
  • Decanal, dimethyl acetal
  • NSC 46132
  • Decanal dimethyl acetal

Work with 1,1-Dimethoxydecane

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1-Dimethoxyoctane10022-28-3100 % similar 1,1-Diethoxyhexane3658-93-354 % similar Pentylcyclohexane4292-92-652 % similar Heptylcyclohexane5617-41-452 % similar 4,4-Dimethoxy-1-butanamine19060-15-250 % similar 1,2-Epoxydecane2404-44-650 % similar 1,2-Epoxydodecane2855-19-850 % similar 2-Hexyloxirane2984-50-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2-Dodecanediol1119-87-5 1,12-Dodecanediol5675-51-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook