(1,4-dimethyl-1H-imidazol-2-yl)methanol

HCID 12923402CAS 59608-81-0

Substructure search Find similar structures

Basic information

Standard SMILES: Cc1cn(C)c(CO)n1
InChIKey: PUSRNHMKIQVRHH-UHFFFAOYSA-N
Molecular formula: C6H10N2O
Average molar mass: 126.16 g/mol

Names & identifiers

Preferred name: (1,4-dimethyl-1H-imidazol-2-yl)methanol
IUPAC: (1,4-dimethylimidazol-2-yl)methanol
English name: (1,4-Dimethyl-1H-imidazol-2-yl)methanol
Molecular formula: C6H10N2O
Molecular weight: 126.16

Names & synonyms

(1,4-DIMETHYL-1H-IMIDAZOL-2-YL)METHANOL59608-81-0RefChem:391439848-551-3MFCD11110199(1,4-DIMETHYLIMIDAZOL-2-YL)METHANOL1,4-dimethyl-2-hydroxymethylimidazolestarbld0025999SCHEMBL8269744PUSRNHMKIQVRHH-UHFFFAOYSA-NJCA60881(1,4-Dimethyl-2-imidazolyl)methanol

Show more names

1H-Imidazole-2-methanol, 1,4-dimethyl-

1,4-dimethyl-2-hydroxymethylimidazolAKOS006307165AB634501,4-dimethyl-2-hydroxymethyl-imidazoleSY480620DB-102971EN300-110068Z1198313368

Database identifiers

CAS: 59608-81-0
PubChem CID: 12923402
EC Number: 848-551-3

Properties

Computed structural properties

XLogP: -0.4
Topological polar surface area: 38.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 9
Formal charge: 0
Complexity: 97.1

Physicochemical properties

Boiling point: 286.6 · 286.6±23.0 °C(Predicted)
Density: 1.13 · 1.13±0.1 g/cm3(Predicted)
pka: 13.88 · 13.88±0.10(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H335-H315
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H319-H335-H315
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362