Basic information
- CAS
5709-62-6- Standard SMILES
OCc1nccn1-c1ccccc1- InChIKey
LYYBODMXAVVCQP-UHFFFAOYSA-N- Molecular formula
- C10H10N2O
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.07931295
Names & identifiers
- Preferred name
- (1-phenyl-1H-imidazol-2-yl)methanol
- IUPAC
- (1-phenylimidazol-2-yl)methanol
- English name
- (1-phenyl-1H-imidazol-2-yl)methanol
- Molecular formula
- C10H10N2O
- Molecular weight
- 174.2
Names & synonyms
(1-phenyl-1h-imidazol-2-yl)methanol5709-62-6DTXSID60972557RefChem:392450DTXCID001400027995-433-3(1-phenylimidazol-2-yl)methanolNSC125683SCHEMBL243235SCHEMBL4314558LYYBODMXAVVCQP-UHFFFAOYSA-N1-Phenyl-1H-imidazole-2-methanol
Show more names
1H-Imidazole-2-methanol, 1-phenyl-
FAA70962AKOS006278327NSC-125683DB-407833EN300-175261G53526Z1198161670
Database identifiers
- CAS
5709-62-6- PubChem CID
- 277166
- DTXSID
DTXSID60972557- EC Number
- 995-433-3
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
Physicochemical properties
- Melting point
- 110 · 110-111 °C
- Boiling point
- 362.7 · 362.7±44.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- pka
- 13.7 · 13.70±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
常州优瑞医药科技有限公司18168818882 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
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