(r)-Cyclopropyl(4-methoxyphenyl)phenylmethanol
Basic information
- CAS
62587-03-5- Standard SMILES
COc1ccc([C@](O)(c2ccccc2)C2CC2)cc1- InChIKey
SIRULVGQLZGELT-KRWDZBQOSA-N- Molecular formula
- C17H18O2
- Average molar mass
- 254.32 g/mol
- Monoisotopic mass
- 254.13067981
Names & identifiers
- Preferred name
- (r)-Cyclopropyl(4-methoxyphenyl)phenylmethanol
- IUPAC
- (R)-cyclopropyl-(4-methoxyphenyl)-phenylmethanol
- English name
- Cyclopropyl 4-methoxydiphenylcarbinol
- Molecular formula
- C17H18O2
- Molecular weight
- 254.32
Names & synonyms
(r)-cyclopropyl(4-methoxyphenyl)phenylmethanolDTXSID80353127RefChem:210935DTXCID4030419062587-03-5(R)-cyclopropyl-(4-methoxyphenyl)-phenylmethanol(R)-Cyclopropyl(4-methoxyphenyl)(phenyl)methanolCyclopropyl 4-methoxydiphenylcarbinolCyclopropyl-4-methoxydiphenylcarbinol,95%ALPHA-CYCLOPROPYL-4-METHOXYDIPHENYLMETHANOLα-Cyclopropyl-4-methoxy-α-phenylbenzenemethanolBenzenemethanol, α-cyclopropyl-4-methoxy-α-phenyl-
Show more names
ALPHA-CYCLOPROPYL-4-METHOXY-ALPHA-PHENYLBENZENEMETHANOL
Database identifiers
- CAS
62587-03-5- PubChem CID
- 736873
- DTXSID
DTXSID80353127- EC Number
- 653-664-4
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 357.54 °C · 357.54°C (rough estimate)
- Density
- 1.0621 · 1.0621 (rough estimate)
- refractive index
- 1.588 · 1.588-1.59
- pka
- 13.547 · 13.547±0.29(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
- Safety Statements
- 24 · 24/25
- HS Code
- 29309099 · 29309099
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- hs_code
- 29309099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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