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N-3,4-methylenedioxyphenyl-N-m-tolylamine

HCID 21998423
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Basic information

Standard SMILES
Cc1cccc(Nc2ccc3c(c2)OCO3)c1
InChIKey
GYHOZCDOOQMMMA-UHFFFAOYSA-N
Molecular formula
C14H13NO2
Average molar mass
227.26 g/mol
Monoisotopic mass
227.09462866

Names & identifiers

Preferred name
N-3,4-methylenedioxyphenyl-N-m-tolylamine
IUPAC
N-(3-methylphenyl)-1,3-benzodioxol-5-amine

Names & synonyms

SCHEMBL7925274GYHOZCDOOQMMMA-UHFFFAOYSA-NN-3,4-methylenedioxyphenyl-N-m-tolylamine

Database identifiers

PubChem CID
21998423

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
30.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
259

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Related reactions

1 records
New reaction record
HRID 1976521 reaction equation
HRID 1976521As productuspto-grants-2001_05

Compound notes

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