Basic information
- CAS
2903-12-0- Standard SMILES
OC1(C2CCCCC2)CCCCC1- InChIKey
PVSNMDAHWMHSBD-UHFFFAOYSA-N- Molecular formula
- C12H22O
- Average molar mass
- 182.3 g/mol
- Monoisotopic mass
- 182.16706532
Names & identifiers
- Preferred name
- [1,1'-Bicyclohexyl]-1-ol
- IUPAC
- 1-cyclohexylcyclohexan-1-ol
- English name
- [1,1'-bicyclohexyl]-1-ol
- Molecular formula
- C12H22O
- Molecular weight
- 182.3
Names & synonyms
(1,1'-Bicyclohexyl)-1-ol2903-12-0[1,1'-Bicyclohexyl]-1-olEINECS 220-799-1DTXSID10183272RefChem:68024DTXCID20105763220-799-11-cyclohexylcyclohexan-1-ol1-cyclohexylcyclohexanol[1,1'-Bi(cyclohexan)]-1-ol[1,1'-Bicyclohexyl]ol
Show more names
1,1'-Bicyclohexan-1-ol
cyclohexylcy-clohexanolSCHEMBL5416171-Cyclohexylcyclohexanol, 97%SCHEMBL2971736CHEMBL5307662SCHEMBL11137503PVSNMDAHWMHSBD-UHFFFAOYSA-NAKOS009995908
Database identifiers
- CAS
2903-12-0- PubChem CID
- 76181
- DTXSID
DTXSID10183272- ChEMBL
CHEMBL5307662- EC Number
- 220-799-1
- Nikkaji
- J306.828E
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Melting point
- 51 °C · 51 °C
- Boiling point
- 148 °C · 148 °C(Press: 20 Torr)
- Density
- 0.9817 g/cm3 · 0.9817 g/cm3
- pka
- 15.18 · 15.18±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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]
P264, P270, P301+P317, P330, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers2 total
扬州瑞宏生物科技有限公司15380367604; 15380367604 · [email protected]
山东彬睿特新材料有限公司0533-2866658 15615638350 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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