HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

4-Benzyloxy-2-(trifluoromethyl)benzayl alcohol

HCID 59547992
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
OCc1ccc(OCc2ccccc2)cc1C(F)(F)F
InChIKey
PZUDYOVZXZBMBO-UHFFFAOYSA-N
Molecular formula
C15H13F3O2
Average molar mass
282.26 g/mol

Names & identifiers

Preferred name
4-Benzyloxy-2-(trifluoromethyl)benzayl alcohol
IUPAC
[4-phenylmethoxy-2-(trifluoromethyl)phenyl]methanol

Names & synonyms

1253188-22-54-Benzyloxy-2-(trifluoromethyl)benzayl alcohol(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)methanolMFCD16038818[4-(benzyloxy)-2-(trifluoromethyl)phenyl]methanol[4-phenylmethoxy-2-(trifluoromethyl)phenyl]methanolSCHEMBL695145[4-[(Phenylmethyl)oxy]-2-(trifluoromethyl)phenyl]methanolDB-092406CS-01942524-Benzyloxy-2-(trifluoromethyl)benzyl alcoholE91084
Show more names
[4-benzyloxy-2-(trifluoromethyl)phenyl]methanolA1-23018

Database identifiers

PubChem CID
59547992

Properties

Computed structural propertiesFilling in

XLogP
3.4
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
287

Related reactions

4 records
New reaction record
HRID 686778 reaction equation
HRID 686778As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1946308 reaction equation
HRID 1946308As productuspto-grants-2013_03
HRID 1946375 reaction equation
HRID 1946375As reactantuspto-grants-2013_03
HRID 2126568 reaction equation
HRID 2126568As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes