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5-Imidazol-1-yl-3-methyl-benzene-1,2-diamine

HCID 10419982
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Basic information

Standard SMILES
Cc1cc(-n2ccnc2)cc(N)c1N
InChIKey
JRHAXYKFTBEDMV-UHFFFAOYSA-N
Molecular formula
C10H12N4
Average molar mass
188.23 g/mol

Names & identifiers

Preferred name
5-Imidazol-1-yl-3-methyl-benzene-1,2-diamine
IUPAC
5-imidazol-1-yl-3-methylbenzene-1,2-diamine

Names & synonyms

5-imidazol-1-yl-3-methyl-benzene-1,2-diamineSCHEMBL5136657JRHAXYKFTBEDMV-UHFFFAOYSA-N

Database identifiers

PubChem CID
10419982

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
69.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
197

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Related reactions

9 records
New reaction record
HRID 665671 reaction equation
HRID 665671As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 970342 reaction equation
HRID 970342As productuspto-grants-2007_12
HRID 1354599 reaction equation
HRID 1354599As productuspto-grants-2007_05
HRID 1354601 reaction equation
HRID 1354601As reactantuspto-grants-2007_05
HRID 1354619 reaction equation
HRID 1354619As reactantuspto-grants-2007_05
HRID 1767006 reaction equation
HRID 1767006As productuspto-grants-2007_06
HRID 1793695 reaction equation
HRID 1793695As productuspto-grants-2006_07
HRID 1793697 reaction equation
HRID 1793697As reactantuspto-grants-2006_07
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Compound notes

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