2-(Diethylamino)-1-phenylethanol
Basic information
- CAS
4249-64-3- Standard SMILES
CCN(CC)CC(O)c1ccccc1- InChIKey
YTVTUNSBFXBFQJ-UHFFFAOYSA-N- Molecular formula
- C12H19NO
- Average molar mass
- 193.28 g/mol
- Monoisotopic mass
- 193.14666423
Names & identifiers
- Preferred name
- 2-(Diethylamino)-1-phenylethanol
- IUPAC
- 2-(diethylamino)-1-phenylethanol
Names & synonyms
2-(diethylamino)-1-phenylethanol4249-64-3DTXSID80279010RefChem:253728DTXCID80230166659-579-92-(diethylamino)-1-phenylethan-1-olNSC11018Benzenemethanol, a-[(diethylamino)methyl]-SCHEMBL5417971NSC23631NSC-11018
Show more names
NSC-23631AKOS008925920DS-010167
Database identifiers
- CAS
4249-64-3- PubChem CID
- 223392
- DTXSID
DTXSID80279010- EC Number
- 659-579-9
- Nikkaji
- J1.583.929E
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 139
Experimental & physicochemical properties
LogP2.02
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, 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. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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