2-Methyl-1,2-propanediol

C₄H₁₀O₂CAS 558-43-090.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₁₀O₂
Molar mass: 90.12 g/mol
Exact mass: 90.0681 Da
Density: 0.997 g/mL (at 20 °C)
Boiling point: 176 °C
logP: -0.25Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

558-43-0

SMILES

CC(C)(O)CO

InChIKey

BTVWZWFKMIUSGS-UHFFFAOYSA-N

InChI

InChI=1S/C4H10O2/c1-4(2,6)3-5/h5-6H,3H2,1-2H3

Weigh it out

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

Names and synonyms

12 names

1,2-Propanediol, 2-methyl-
Isobutylene glycol
Isobutene glycol
2-Hydroxy-2-methylpropanol
1,2-Dihydroxyisobutane
2-Methyl-2-hydroxypropanol
1,2-Dihydroxy-2-methylpropane
1,1-Dimethyl-1,2-ethanediol
2-Methyl-2-hydroxy-1-propanol
2-Hydroxy-2-methyl-1-propyl alcohol
2-Methyl-2-hydroxy-1-propyl alcohol
1,1-Dimethylethylene glycol

Work with 2-Methyl-1,2-propanediol

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

2,5-Dimethyl-2,5-hexanediol110-03-253 % similar 3-Methyl-1,3-butanediol2568-33-450 % similar tert-Amyl alcohol75-85-447 % similar Trimethylolethane77-85-047 % similar 1-Amino-2-methyl-2-propanol2854-16-245 % similar 1-Chloro-2-methyl-2-propanol558-42-945 % similar Neopentyl glycol126-30-744 % similar 2-Methyl-2-pentanol590-36-343 % similar

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

Same formula

1,3-Butanediol107-88-0 Propylene glycol methyl ether107-98-2 1,4-Butanediol110-63-4 Dimethoxyethane110-71-4 2-Ethoxyethanol110-80-5 Propylene glycol monomethyl ether1320-67-8 2-Methoxy-1-propanol1589-47-5 3-Methoxy-1-propanol1589-49-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook