5,6-Dimethyl-1-benzimidazolemethanol
Basic information
- CAS
19539-34-5- Standard SMILES
Cc1cc2ncn(CO)c2cc1C- InChIKey
PFCNDSQZKWGKTN-UHFFFAOYSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.09496301
Names & identifiers
- Preferred name
- 5,6-Dimethyl-1-benzimidazolemethanol
- IUPAC
- (5,6-dimethylbenzimidazol-1-yl)methanol
- English name
- 1H-Benzimidazole-1-methanol,5,6-dimethyl-(9CI)
- Molecular formula
- C10H12N2O
- Molecular weight
- 176.22
Names & synonyms
5,6-DIMETHYL-1-BENZIMIDAZOLEMETHANOLRefChem:528093654-677-819539-34-5(5,6-dimethyl-1h-benzimidazol-1-yl)methanol(5,6-dimethylbenzimidazol-1-yl)methanol1H-Benzimidazole-1-methanol,5,6-dimethyl-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)methanol(5,6-Dimethyl-1H-benzo[d]imidazol-1-yl)methanol1H-Benzimidazole-1-methanol,5,6-dimethyl-(9CI)NSC163162DTXSID60941309
Show more names
AKOS024332214NSC-163162(5,6-Dimethyl-1H-1,3-benzimidazol-1-yl)methanol
Database identifiers
- CAS
19539-34-5- PubChem CID
- 294532
- DTXSID
DTXSID60941309- EC Number
- 654-677-8
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Melting point
- 195 · 195-197 °C (decomp)
- Boiling point
- 354.6 · 354.6±44.0 °C(Predicted)
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 13.82 · 13.82±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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