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1-[(2-Chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine

HCID 7019331
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
832738-04-2
Standard SMILES
Nc1ncn(Cc2ccccc2Cl)n1
InChIKey
AYHQHOGLGCSGJN-UHFFFAOYSA-N
Molecular formula
C9H9ClN4
Average molar mass
208.652 g/mol
Monoisotopic mass
208.05157397

Names & identifiers

Preferred name
1-[(2-Chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine
IUPAC
1-[(2-Chlorophenyl)methyl]-1H-1,2,4-triazol-3-amine
English name
1-(2-chlorobenzyl)-1H-1,2,4-triazol-3-amine
Molecular formula
C9H9ClN4
Molecular weight
208.65

Names & synonyms

1-(2-chlorobenzyl)-1H-1,2,4-triazol-3-amine1-[(2-chlorophenyl)methyl]-1h-1,2,4-triazol-3-amine1H-1,2,4-Triazol-3-amine, 1-[(2-chlorophenyl)methyl]-

Database identifiers

CAS
832738-04-2
PubChem CID
7019331
DTXSID
DTXSID201222423

Properties

Physicochemical properties

Boiling point
424.1 · 424.1±47.0 °C(Predicted)
Density
1.42 · 1.42±0.1 g/cm3(Predicted)
pka
4.11 · 4.11±0.12(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Chemistry & industry

Suppliers1 total

南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]

Related reactions

4 records
New reaction record
HRID 2063638 reaction equation
HRID 2063638As productuspto-grants-2012_10
HRID 2063639 reaction equation
HRID 2063639As reactantuspto-grants-2012_10
HRID 2139320 reaction equation
HRID 2139320As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2316628 reaction equation
HRID 2316628As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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