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

2,3-Dihydro-5-phenyl-4-benzofuranamine

HCID 21852182
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1c(-c2ccccc2)ccc2c1CCO2
InChIKey
FPQXIICFZLQIQJ-UHFFFAOYSA-N
Molecular formula
C14H13NO
Average molar mass
211.26 g/mol
Monoisotopic mass
211.09971404

Names & identifiers

Preferred name
2,3-Dihydro-5-phenyl-4-benzofuranamine
IUPAC
5-phenyl-2,3-dihydro-1-benzofuran-4-amine

Names & synonyms

SCHEMBL8473747FPQXIICFZLQIQJ-UHFFFAOYSA-N2,3-dihydro-5-phenyl-4-benzofuranamine

Database identifiers

PubChem CID
21852182

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
237

Related reactions

3 records
New reaction record
HRID 617409 reaction equation
HRID 617409As productuspto-grants-1999_09
HRID 617410 reaction equation
HRID 617410As reactantuspto-grants-1999_09
HRID 2133337 reaction equation
HRID 2133337As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes