1-benzyl-2-(chloromethyl)-1H-imidazole hydrochloride

HCID 2779243

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Basic information

CAS: 19276-03-0
Standard SMILES: Cl.ClCc1nccn1Cc1ccccc1
InChIKey: IOOCHXMDSFPOGL-UHFFFAOYSA-N
Molecular formula: C11H12Cl2N2
Average molar mass: 243.13 g/mol
Monoisotopic mass: 242.03775374

Names & identifiers

Preferred name: 1-benzyl-2-(chloromethyl)-1H-imidazole hydrochloride
IUPAC: 1-benzyl-2-(chloromethyl)imidazole;hydrochloride
English name: 1-Benzyl-2-(chloromethyl)-1H-imidazole HCl
Molecular formula: C11H12Cl2N2
Molecular weight: 243.13

Names & synonyms

19276-03-01-Benzyl-2-(chloromethyl)-1H-imidazole hydrochloride1-benzyl-2-chloromethylimidazole hydrochlorideCHEBI:53367DTXSID403813451H-Imidazole, 2-(chloromethyl)-1-(phenylmethyl)-, hydrochloride (1:1)RefChem:429784DTXCID20332370871-503-8chlormethylimidazoline HCl1-benzyl-2-(chloromethyl)-1h-imidazole hcl1-benzyl-2-(chloromethyl)imidazole Hydrochloride

Show more names

BUTTPARK 93\04-051-BENZYL-2-(CHLOROMETHYL)-1H-IMIDAZOLE HCI1-(benzyl)-2-(chloromethyl)imidazol-1-ium chloride2-(chloromethyl)-1-(phenylmethyl)imidazole hydrochloride2-(chloromethyl)-1-(phenylmethyl)imidazol-1-ium chloride

MFCD000352101-benzyl-2-(chloromethyl)imidazole;hydrochloride2-(chloromethyl)-1-benzylimidazole, chlorideEpitope ID:114083SCHEMBL9544381-Benzyl-2-(chloromethyl)-1H -imidazole hydrochlorideIOOCHXMDSFPOGL-UHFFFAOYSA-NSBB099690

Database identifiers

CAS: 19276-03-0
PubChem CID: 2779243
DTXSID: DTXSID40381345
EC Number: 871-503-8

Properties

Computed structural properties

Topological polar surface area: 17.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 169

Physicochemical properties

Melting point: 186 °C · 186 °C
CAS DataBase Reference: 19276 · 19276-03-0(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H332-H315-H319-H302
Precautionary statements: 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38-41
Safety Statements: 26 · 26-36/37/39-39
Hazard Note: Irritant

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+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%)

Safety data

risk_code: 36/37/38-41
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-36/37/39-39
Hazard statements: H335-H332-H315-H319-H302
Precautionary statements: P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P