5-(chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride

HCID 22285332

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Basic information

CAS: 104256-69-1
Standard SMILES: Cl.Cn1ncnc1CCl
InChIKey: ZESCZOKYYXYNNQ-UHFFFAOYSA-N
Molecular formula: C4H7Cl2N3
Average molar mass: 168.02 g/mol
Monoisotopic mass: 167.0017026

Names & identifiers

Preferred name: 5-(chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride
IUPAC: 5-(chloromethyl)-1-methyl-1,2,4-triazole;hydrochloride
English name: 5-Chloromethyl-1-methyl-1H-[1,2,4]triazole hydrochloride
Molecular formula: C4H7Cl2N3
Molecular weight: 168.02

Names & synonyms

104256-69-15-(CHLOROMETHYL)-1-METHYL-1H-1,2,4-TRIAZOLE HYDROCHLORIDERefChem:530927850-438-95-Chloromethyl-1-methyl-1H-[1,2,4]triazole hydrochlorideMFCD098632585-(chloromethyl)-1-methyl-1,2,4-triazole;hydrochloride1H-1,2,4-Triazole,5-(chloromethyl)-1-methyl-, hydrochloride (1:1)ZESCZOKYYXYNNQ-UHFFFAOYSA-N5-(chloromethyl)-1-methyl-1,2,4-triazole hydrochloride5-Chloromethyl-1-methyl-1H-[1,2,4]triazole HClSCHEMBL941062

Show more names

5-(chloromethyl)-1-methyl-1,2,4-triazole

5-chloromethyl-1-methyl-1H-1,2,4-triazole hydrochlorideTQP0651EEA25669AKOS022193571MB07932DA-16004SY194407CS-0076498

Database identifiers

CAS: 104256-69-1
PubChem CID: 22285332
EC Number: 850-438-9

Properties

Computed structural properties

Topological polar surface area: 30.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 9
Formal charge: 0
Complexity: 77

Physicochemical properties

storage temp.: Store at room temperature, keep dry and cool
Appearance: Light brown to brown Solid
Symbol(GHS): 7 · GHS07,GHS05
Signal word: Danger
Hazard statements: 335 · H335-H302-H315-H318
Precautionary statements: 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310

Safety & regulation

GHS classification

GHS Classification · 5 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

Safety data

Signal word: Danger
Symbol(GHS): GHS07,GHS05
Hazard statements: H335-H302-H315-H318
Precautionary statements: P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310