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

5-Amino-2-acetoxyindane

HCID 22498812
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)OC1Cc2ccc(N)cc2C1
InChIKey
SYCDOUXQGDYZFL-UHFFFAOYSA-N
Molecular formula
C11H13NO2
Average molar mass
191.23 g/mol
Monoisotopic mass
191.09462866

Names & identifiers

Preferred name
5-Amino-2-acetoxyindane
IUPAC
(5-amino-2,3-dihydro-1H-inden-2-yl) acetate

Names & synonyms

5-amino-2-acetoxyindane5-amino-2-acetoxyindanSCHEMBL6200513SYCDOUXQGDYZFL-UHFFFAOYSA-N

Database identifiers

PubChem CID
22498812

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
52.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
229

Related reactions

1 records
New reaction record
HRID 267562 reaction equation
HRID 267562As productuspto-grants-1976_03

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes