Basic information
- CAS
945-49-3- Standard SMILES
OC(c1ccccc1)C1CCCCC1- InChIKey
QDYKZBKCLHBUHU-UHFFFAOYSA-N- Molecular formula
- C13H18O
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.13576519
Names & identifiers
- Preferred name
- alpha-Cyclohexylbenzenemethanol
- IUPAC
- cyclohexyl(phenyl)methanol
- English name
- Cyclohexyl(phenyl)methanol
- Molecular formula
- C13H18O
- Molecular weight
- 190.29
Names & synonyms
Cyclohexyl(phenyl)methanol945-49-3alpha-CyclohexylbenzenemethanolNSC-28611US3WRF29BDDTXSID30872858RefChem:1076462DTXCID10820418Methanol, cyclohexylphenyl-Benzenemethanol, alpha-cyclohexyl-MFCD00019357Benzenemethanol, a-cyclohexyl-
Show more names
AURORA KA-6956cyclohexylphenyl-methanoPhenylcyclohexylmethanolα-CyclohexylbenzenemethanolBenzenemethanol, α-cyclohexyl-alpha-phenyl-cyclohexanemethano1-(5-Methyl-3-phenylisoxazol-4-yl)ethan-1-ol4-(1-Hydroxyethyl)-5-methyl-3-phenylisoxazoleCyclohexyl(phenyl)carbinol, [Hydroxy(phenyl)methyl]cyclohexane
Cyclohexylphenylmethanolcyclohexylphenylmethan-1-olCyclohexanemethanol, alpha-phenyl-NSC 28611BRN 2048295NSC28611Benzenemethanol, .alpha.-cyclohexyl-Cyclohexylphenylcarbinol
Database identifiers
- CAS
945-49-3- PubChem CID
- 95668
- DTXSID
DTXSID30872858- UNII
- US3WRF29BD
- EC Number
- 640-542-0
- Nikkaji
- J41.748C
Properties
Computed structural properties
- XLogP
- 3.4
- 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
- 155
Physicochemical properties
- Melting point
- 41 °C · 41 °C
- Boiling point
- 168 °C · 168 °C(Press: 20 Torr)
- Density
- 1.039 · 1.039±0.06 g/cm3(Predicted)
- pka
- 14.36 · 14.36±0.20(Predicted)
- form
- crystalline solid
- color
- White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P280
- Hazard Codes
- Xi
- HS Code
- 2906190090 · 2906190090
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)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2906190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271-P280
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers20 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
济南高德医药科技有限公司+86-0086-531-55562571，18953105926 13553167512 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
济南荣科药业有限公司18615606162 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
江苏艾康生物医药研发有限公司
Related reactions
1 records
Compound notes
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