2-Azido-2,3-dihydro-1H-inden-1-ol

HCID 21998096

Notes Reactions

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Basic information

CAS: 1008361-84-9
Standard SMILES: [N-]=[N+]=NC1Cc2ccccc2C1O
InChIKey: GXARJZSMOVQDPH-UHFFFAOYSA-N
Molecular formula: C9H9N3O
Average molar mass: 175.19 g/mol
Monoisotopic mass: 175.07456191

Names & identifiers

Preferred name: 2-Azido-2,3-dihydro-1H-inden-1-ol
IUPAC: 2-azido-2,3-dihydro-1H-inden-1-ol

Names & synonyms

2-azido-2,3-dihydro-1h-inden-1-ol1008361-84-9RefChem:256213SCHEMBL14302125DTXSID701300193

Database identifiers

CAS: 1008361-84-9
PubChem CID: 21998096
DTXSID: DTXSID701300193

Properties

Computed structural propertiesFilling in

XLogP: 2
Topological polar surface area: 34.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 237

Related reactions

2 records

New reaction record

HRID 177792 reaction equation

HRID 177792As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 285853 reaction equation

HRID 285853As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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