HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

(3-(Benzyloxy)phenyl)(2-methylcyclopropyl)methanone

HCID 57706540
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1CC1C(=O)c1cccc(OCc2ccccc2)c1
InChIKey
IZAPNNDODNFBSW-UHFFFAOYSA-N
Molecular formula
C18H18O2
Average molar mass
266.3 g/mol

Names & identifiers

Preferred name
(3-(Benzyloxy)phenyl)(2-methylcyclopropyl)methanone
IUPAC
(2-methylcyclopropyl)-(3-phenylmethoxyphenyl)methanone

Names & synonyms

SCHEMBL2499140IZAPNNDODNFBSW-UHFFFAOYSA-N(3-(Benzyloxy)phenyl)(2-methylcyclopropyl)methanone

Database identifiers

PubChem CID
57706540

Properties

Computed structural properties

XLogP
4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
20
Formal charge
0
Complexity
332

Related reactions

2 records
New reaction record
HRID 210594 reaction equation
HRID 210594As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1662570 reaction equation
HRID 1662570As productuspto-grants-2011_10

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes