4,5-dimethoxy-2,3-dihydro-1H-inden-2-amine

HCID 12756381

Notes Reactions

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Basic information

CAS: 83598-56-5
Standard SMILES: COc1ccc2c(c1OC)CC(N)C2
InChIKey: OVOZNCAEVHJDNY-UHFFFAOYSA-N
Molecular formula: C11H15NO2
Average molar mass: 193.24 g/mol
Monoisotopic mass: 193.11027872

Names & identifiers

Preferred name: 4,5-dimethoxy-2,3-dihydro-1H-inden-2-amine
IUPAC: 4,5-dimethoxy-2,3-dihydro-1H-inden-2-amine

Names & synonyms

83598-56-54,5-dimethoxy-2,3-dihydro-1H-inden-2-amine2-Amino-4,5-dimethoxyindane2-amino-4,5-dimethyoxyindaneSCHEMBL8542873CHEMBL1191687OVOZNCAEVHJDNY-UHFFFAOYSA-NDTXSID501264941MFCD20695878SY3712952,3-Dihydro-4,5-dimethoxy-1H-inden-2-amineEN300-8639719

Database identifiers

CAS: 83598-56-5
PubChem CID: 12756381
DTXSID: DTXSID501264941
ChEMBL: CHEMBL1191687

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 44.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 198

Related reactions

2 records

New reaction record

HRID 233820As reactantuspto-grants-1997_01

HRID 1721396As reactantuspto-grants-1996_04

Compound notes

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