1,3-Dimethoxy-2-propanol
Properties
- Molecular formula
- C5H12O3
- Molar mass
- 120.15 g/mol
- Exact mass
- 120.0786 Da
- Density
- 1.0085 g/mL (at 20 °C)
- Boiling point
- 169 °C
- logP
- -0.36Crippen estimate
- Polar surface area
- 38.7 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 4
Hazards
Warning
- H226 Flammable liquid and vapor100% of notifiers
- H336 May cause drowsiness or dizziness33.3% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P271, P280, P303+P361+P353, P304+P340, P319, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
623-69-8SMILES
COCC(O)COCInChIKey
ZESKRVSPQJVIMH-UHFFFAOYSA-NInChI
InChI=1S/C5H12O3/c1-7-3-5(6)4-8-2/h5-6H,3-4H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- 2-Propanol, 1,3-dimethoxy-
- Glycerol 1,3-dimethyl ether
- 1,3-Dimethoxy-2-hydroxypropane
- NSC 263483
- 1,3-Dimethoxypropane-2-ol
Work with 1,3-Dimethoxy-2-propanol
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
3-Methoxy-1,2-propanediol36887-04-470 % similar
3-Methoxy-1,2-propanediol623-39-270 % similar
Propylene glycol methyl ether107-98-252 % similar
(2S)-1-Methoxypropan-2-ol26550-55-052 % similar
(R)-(-)-1-Methoxy-2-propanol4984-22-952 % similar
Oxetan-3-ol7748-36-950 % similar
1,3-Diethoxy-2-propanol4043-59-845 % similar
1,3-Dioxan-5-ol4740-78-745 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.