Basic information
- CAS
80866-79-1- Standard SMILES
OCC1(c2ccc(Cl)cc2)CCCC1- InChIKey
JPVGEFSYKNYYAU-UHFFFAOYSA-N- Molecular formula
- C12H15ClO
- Average molar mass
- 210.7 g/mol
- Monoisotopic mass
- 210.08114278
Names & identifiers
- Preferred name
- 1-(p-Chlorophenyl)cyclopentanemethanol
- IUPAC
- [1-(4-chlorophenyl)cyclopentyl]methanol
- English name
- 1-(p-chlorophenyl)cyclopentanemethanol
- Molecular formula
- C12H15ClO
- Molecular weight
- 210.7
Names & synonyms
80866-79-1[1-(4-chlorophenyl)cyclopentyl]methanol(1-(4-Chlorophenyl)cyclopentyl)methanol1-(p-Chlorophenyl)cyclopentanemethanolCyclopentanemethanol,1-(4-chlorophenyl)-1-(4-Chlorophenyl)cyclopentanemethanolEINECS 279-583-0SCHEMBL5873448DTXSID201001594AKOS023422049TS-03000[1-(4-chlorophenyl)-cyclopentyl]-methanol
Show more names
Cyclopentanemethanol, 1-(4-chlorophenyl)-1-(4-CHLOROPHENYL)-1-CYCLOPENTANEMETHANOL
[1-(4-chlorophenyl)-1-cyclopentyl]methanolCS-0362744NS00061330G85823F753864
Database identifiers
- CAS
80866-79-1- PubChem CID
- 2724017
- DTXSID
DTXSID201001594- EC Number
- 279-583-0
- Nikkaji
- J320.326C
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Boiling point
- 314.3 · 314.3±25.0 °C(Predicted)
- Density
- 1.158 · 1.158±0.06 g/cm3(Predicted)
- pka
- 15.05 · 15.05±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers7 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
常州锐博生物科技有限公司0519-81884608 18205027398 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
Related reactions
10 records
Compound notes
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