2-(Hydroxymethyl)-1,3-propanediol

C4H10O3CAS 4704-94-3106.12 g/mol

HOHOOH
Alcohol

Properties

Molecular formula
C4H10O3
Molar mass
106.12 g/mol
Exact mass
106.0630 Da
Melting point
182 °C
Boiling point
158 °C (at 1.5 Torr)
logP
-1.42Crippen estimate
Polar surface area
60.7 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
4704-94-3
SMILES
OCC(CO)CO
InChIKey
SFRDXVJWXWOTEW-UHFFFAOYSA-N
InChI
InChI=1S/C4H10O3/c5-1-4(2-6)3-7/h4-7H,1-3H2

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Names and synonyms

3 names
  • 1,3-Propanediol, 2-(hydroxymethyl)-
  • Tris(hydroxymethyl)methane
  • Trimethylolmethane

Work with 2-(Hydroxymethyl)-1,3-propanediol

Similar compounds

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

Same formula

Elsewhere