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1-Methyl-1H-1,2,4-Triazol-3-Amine Hydrochloride

HCID 45075172
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Basic information

CAS
1185300-35-9
Standard SMILES
Cl.Cn1cnc(N)n1
InChIKey
PSHNLOQTZVNZGF-UHFFFAOYSA-N
Molecular formula
C3H7ClN4
Average molar mass
134.57 g/mol
Monoisotopic mass
134.0359239

Names & identifiers

Preferred name
1-Methyl-1H-1,2,4-Triazol-3-Amine Hydrochloride
IUPAC
1-methyl-1,2,4-triazol-3-amine;hydrochloride
English name
1-METHYL-1H-[1,2,4]TRIAZOL-3-YLAMINE HYDROCHLORIDE
Molecular formula
C3H7ClN4
Molecular weight
134.57

Names & synonyms

1-Methyl-1H-1,2,4-Triazol-3-Amine Hydrochloride1211507-65-1MFCD077811151-methyl-1,2,4-triazol-3-amine;hydrochlorideAKOS015959189AT12103BS-389991-Methyl-1H-1,2,4-triazol-3-amine HClDB-391102CS-03387031-Methyl-1H-1,2,4-Triazol-3-AmineHydrochlorideF358697
Show more names
1-METHYL-1H-[1,2,4]TRIAZOL-3-YLAMINE HYDROCHLORIDE
1-Methyl-1H-1,2,4-triazol-3-amine hydrochloride, AldrichCPR

Database identifiers

CAS
1185300-35-9
PubChem CID
45075172

Properties

Computed structural propertiesFilling in

Topological polar surface area
56.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
8
Formal charge
0
Complexity
64

Physicochemical properties

form
solid
InChI
1S/C3H6N4.ClH/c1-7-2-5-3(4)6-7;/h2H,1H3,(H2,4,6);1H
InChIKey
PSHNLOQTZVNZGF-UHFFFAOYSA-N
SMILES
NC1=NN(C)C=N1.[H]Cl
UNSPSC Code
12352116 · 12352116
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338
Hazard Codes
Xi
WGK Germany
3 · WGK 3
Storage Class
11 · 11 - Combustible Solids

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

wgk
WGK 3
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
Storage Class
11 - Combustible Solids
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Related reactions

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Compound notes

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