(2R)-1-phenylbutan-2-ol
Basic information
- CAS
29393-19-9- Standard SMILES
CC[C@@H](O)Cc1ccccc1- InChIKey
LYUPJHVGLFETDG-SNVBAGLBSA-N- Molecular formula
- C10H14O
- Average molar mass
- 150.22 g/mol
- Monoisotopic mass
- 150.10446507
Names & identifiers
- Preferred name
- (2R)-1-phenylbutan-2-ol
- IUPAC
- (2R)-1-phenylbutan-2-ol
Names & synonyms
(2R)-1-phenylbutan-2-ol29393-19-9RefChem:396869992-482-2Benzeneethanol, a-ethyl-, (aR)-1-phenyl-butan-2-olSCHEMBL2479860LYUPJHVGLFETDG-SNVBAGLBSA-NAKOS034799613CS-0264071EN300-91691Z1262397064
Database identifiers
- CAS
29393-19-9- PubChem CID
- 7003733
- EC Number
- 992-482-2
- Nikkaji
- J78.321H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 95
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
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
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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