UK 78282
Basic information
- CAS
191217-42-2- Standard SMILES
COc1ccc(CCCN2CCC(COC(c3ccccc3)c3ccccc3)CC2)cc1- InChIKey
WRTXEGOLODUQIE-UHFFFAOYSA-N- Molecular formula
- C29H35NO2
- Average molar mass
- 429.6 g/mol
- Monoisotopic mass
- 429.26677936
Overview
UK 78282 is a diarylmethane.
Names & identifiers
- Preferred name
- UK 78282
- IUPAC
- 4-(benzhydryloxymethyl)-1-[3-(4-methoxyphenyl)propyl]piperidine
- English name
- Piperidine, 4-[(diphenylmethoxy)methyl]-1-[3-(4-methoxyphenyl)propyl]-
- Molecular formula
- C29H35NO2
- Molecular weight
- 429.59
Names & synonyms
UK 78282RefChem:509776UK-78282CHEMBL96534-(benzhydryloxymethyl)-1-[3-(4-methoxyphenyl)propyl]piperidineC13848191217-42-2AC1LCVJESCHEMBL29386967CHEBI:35042BDBM50098785DNC004154
Show more names
Piperidine, 4-[(diphenylmethoxy)methyl]-1-[3-(4-methoxyphenyl)propyl]-
NCGC00370962-01Q271163844-(diphenylmethoxymethyl)-1-(3-(4-methoxyphenyl)propyl)piperidine4-Benzhydryloxymethyl-1-[3-(4-methoxy-phenyl)-propyl]-piperidine
Database identifiers
- CAS
191217-42-2- PubChem CID
- 656768
- ChEMBL
CHEMBL9653- ChEBI
CHEBI:35042- EC Number
- 683-420-2
- Nikkaji
- J1.102.194H
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 465
Physicochemical properties
- Boiling point
- 549.2 · 549.2±45.0 °C(Predicted)
- Density
- 1.061 · 1.061±0.06 g/cm3(Predicted)
- pka
- 9.24 · 9.24±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410-H319
- Precautionary statements
- 273 · P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P
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, P273, P280, P305+P351+P338, P337+P317, P391, 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. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H410-H319
- Precautionary statements
- P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Additional notes
DefinitionChEBI: UK 78282 is a diarylmethane.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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