CAS 57928-60-6 4-(Benzyloxy)benzene-1-carboximidamide hydrochloride (HCID 11242483)

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Basic information

CAS: 57928-60-6
Standard SMILES: Cl.N=C(N)c1ccc(OCc2ccccc2)cc1
InChIKey: YYXKRNUJMKSJMF-UHFFFAOYSA-N
Molecular formula: C14H15ClN2O
Average molar mass: 262.73 g/mol
Monoisotopic mass: 262.08729078

Names & identifiers

Preferred name: 4-(Benzyloxy)benzene-1-carboximidamide hydrochloride
IUPAC: 4-phenylmethoxybenzenecarboximidamide;hydrochloride
English name: 4-Benzyloxy-benzamidine
Molecular formula: C14H14N2O
Molecular weight: 226.27

Names & synonyms

4-(benzyloxy)benzene-1-carboximidamide hydrochlorideRefChem:515248831-682-557928-60-64-(BENZYLOXY)BENZIMIDAMIDE HYDROCHLORIDE4-Benzyloxybenzamidine hydrochloride4-BENZYLOXY-BENZAMIDINE HYDROCHLORIDEMFCD067385644-phenylmethoxybenzenecarboximidamide;hydrochloride4-phenylmethoxybenzenecarboximidamide HydrochlorideSCHEMBL1034406CHEMBL2286481

Show more names

4-Benzyloxy-benzamidine4-(benzyloxy)benzene-1-carboxiMidaMide

DTXSID80459895YYXKRNUJMKSJMF-UHFFFAOYSA-NAKOS015846802AS-93914SY184025CS-02516584-(BENZYLOXY)BENZIMIDAMIDEHYDROCHLORIDEEN300-55645

Database identifiers

CAS: 57928-60-6
PubChem CID: 11242483
DTXSID: DTXSID80459895
ChEMBL: CHEMBL2286481
EC Number: 831-682-5

Properties

Computed structural properties

Topological polar surface area: 59.1 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 18
Formal charge: 0
Complexity: 241

Physicochemical properties

Melting point: 181 · 181-182 °C(Solv: ethyl ether (60-29-7))
storage temp.: Sealed in dry,Room Temperature
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H319-H302-H315
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

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, 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

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H335-H319-H302-H315
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501