2-Methoxy-1-propanol

C₄H₁₀O₂CAS 1589-47-590.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₁₀O₂
Molar mass: 90.12 g/mol
Exact mass: 90.0681 Da
Density: 0.938 g/mL (at 20 °C)
Boiling point: 130 °C
Flash point: 33 °C
logP: 0.01Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Danger

H226 Flammable liquid and vaporFlammable liquids
H315 Causes skin irritationSkin corrosion/irritation
H318 Causes serious eye damageSerious eye damage/eye irritation
H335 May cause respiratory irritationSpecific target organ toxicity, single exposure; Respiratory tract irritation
H360D *** May damage the unborn childReproductive toxicity

Harmonised EU classification (CLP Annex VI, index 603-106-00-0), via PubChem.

Precautionary statements

P203, P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P318, P319, P321, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

1589-47-5

SMILES

COC(C)CO

InChIKey

YTTFFPATQICAQN-UHFFFAOYSA-N

InChI

InChI=1S/C4H10O2/c1-4(3-5)6-2/h4-5H,3H2,1-2H3

Weigh it out

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

Names and synonyms

3 names

1-Propanol, 2-methoxy-
2-Methoxypropanol
2-Methoxy-1-hydroxypropane

Work with 2-Methoxy-1-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-Methoxybutanol2517-43-357 % similar 2,2-Dimethoxyethanol30934-97-552 % similar 1,1,3-Trimethoxybutane10138-89-348 % similar Propylene glycol dimethyl ether7778-85-048 % similar Dipropylene glycol25265-71-841 % similar Hydroxypropyl methacrylate27813-02-141 % similar 2-Methyl-1,3-propanediol2163-42-038 % similar Isobutanol78-83-138 % 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 3-Methoxy-1-propanol1589-49-7 (+)-2,3-Butanediol19132-06-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook