Basic information
- CAS
1123-73-5- Standard SMILES
CCc1cccc(O)c1C- InChIKey
IVFJPARIJHUGPZ-UHFFFAOYSA-N- Molecular formula
- C9H12O
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.088815
Names & identifiers
- Preferred name
- 3-Ethyl-o-cresol
- IUPAC
- 3-ethyl-2-methylphenol
- English name
- 3-ethyl-o-cresol
- Molecular formula
- C9H12O
- Molecular weight
- 136.19
Names & synonyms
3-ethyl-2-methylphenol3-Ethyl-o-cresol1123-73-5EINECS 214-377-6DTXSID00149983RefChem:501426DTXCID1072474214-377-6RMU9T63UW8o-Cresol, 3-ethyl-ETHYLMETHYLPHENOLUNII-RMU9T63UW8
Show more names
2-Methyl-3-ethylphenol
Phenol, 3-ethyl-2-methyl-SCHEMBL2021799SCHEMBL3417620SCHEMBL9359711SCHEMBL27876430SCHEMBL30970850IVFJPARIJHUGPZ-UHFFFAOYSA-NMB24030
Database identifiers
- CAS
1123-73-5- PubChem CID
- 34858
- DTXSID
DTXSID00149983- UNII
- RMU9T63UW8
- EC Number
- 214-377-6
- Nikkaji
- J203.357G
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Melting point
- 71 °C · 71°C
- Boiling point
- 227 °C · 227°C
- Density
- 0.9809 · 0.9809 (estimate)
- refractive index
- 1.5135 · 1.5135 (estimate)
- FDA UNII
- 9 T63UW8 · RMU9T63UW8
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H315-H335-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H315-H335-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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