1,2,3,4-Tetrahydro-1-naphthaleneethanol
Basic information
- CAS
68480-12-6- Standard SMILES
OCCC1CCCc2ccccc21- InChIKey
AIHUOSMQBXJRER-UHFFFAOYSA-N- Molecular formula
- C12H16O
- Average molar mass
- 176.25 g/mol
- Monoisotopic mass
- 176.12011513
Names & identifiers
- Preferred name
- 1,2,3,4-Tetrahydro-1-naphthaleneethanol
- IUPAC
- 2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
- English name
- 1,2,3,4-tetrahydronaphthalene-1-ethanol
- Molecular formula
- C12H16O
- Molecular weight
- 176.25
Names & synonyms
68480-12-61-Naphthaleneethanol, 1,2,3,4-tetrahydro-1,2,3,4-Tetrahydro-1-naphthaleneethanolUNII-F093AWN8YQF093AWN8YQEINECS 270-888-4NSC-71475DTXSID40887413NSC 71475RefChem:71302DTXCID201026708270-888-4
Show more names
4-tetrahydronaphthalen-1-yl)ethanol
2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol1,2,3,4-Tetrahydronaphthalene-1-ethanol2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethan-1-olMFCD12828571tetraline-ethanolNSC714752-tetralin-1-ylethanoltetrahydronaphthalene-1-ethanol
Database identifiers
- CAS
68480-12-6- PubChem CID
- 98036
- DTXSID
DTXSID40887413- UNII
- F093AWN8YQ
- EC Number
- 270-888-4
- Nikkaji
- J326.637K
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Boiling point
- 175 · 175-176 °C(Press: 14 Torr)
- Density
- 1.028 · 1.028±0.06 g/cm3(Predicted)
- pka
- 15.03 · 15.03±0.10(Predicted)
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 2.808 · 2.808 (est)
- FDA UNII
- 93 AWN8YQ · F093AWN8YQ
- EPA Substance Registry System
- 1 · 1-Naphthaleneethanol, 1,2,3,4-tetrahydro- (68480-12-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1-Naphthaleneethanol, 1,2,3,4-tetrahydro-
Other Safety InformationIMAP assessments - 1-Naphthaleneethanol, 1,2,3,4-tetrahydro-: Human health tier I assessment
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Naphthaleneethanol, 1,2,3,4-tetrahydro-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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