4-Amidinobenzamide Hydrochloride

HCID 2724293

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Basic information

CAS: 59855-11-7
Standard SMILES: Cl.N=C(N)c1ccc(C(N)=O)cc1
InChIKey: IYIAWOSYBLPUNL-UHFFFAOYSA-N
Molecular formula: C8H10ClN3O
Average molar mass: 199.64 g/mol

Names & identifiers

Preferred name: 4-Amidinobenzamide Hydrochloride
IUPAC: 4-carbamimidoylbenzamide;hydrochloride
English name: 4-Amidinobenzamide hydrochloride
Molecular formula: C8H10ClN3O
Molecular weight: 199.64

Names & synonyms

4-Amidinobenzamide HydrochlorideRefChem:517371621-238-74-carbamimidoylbenzamide Hydrochloride59855-11-7MFCD000130114-carbamimidoylbenzamide;hydrochlorideAKOS015888280FS-1000A1062CS-00677824-AMIDINOBENZAMIDE HCL

Show more names

4-AmidinobenzamideHCl4-carbamimidoylbenzamide4-aminobenzamide hydrochloride4-Carbamidoylbenzamide hydrochloride4-Amidinobenzamide Hydrochloride >4-Amidinobenzamide hydrochloride,99%P-AMIDINOBENZAMIDE HYDROCHLORIDE 99%4-CARBAMIMIDOYL-BENZAMIDE,HYDROCHLORIDE

54050-86-14-amidino-benzoic acid amide hydrochloride4-Amidinobenzamide, HClAM20040811FT-0617418Benzamide, 4-(aminoiminomethyl)-, hydrochloride4-AMIDINOBENZAMIDE HA832509

Database identifiers

CAS: 59855-11-7
PubChem CID: 2724293
EC Number: 621-238-7

Properties

Computed structural properties

Topological polar surface area: 93 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 194

Physicochemical properties

Melting point: 302 · 302-303 °C(lit.)
storage temp.: Inert atmosphere,Room Temperature
solubility: 2 O: · H2O: 20 mg/mL, clear, colorless
form: powder to crystal
color: White to Almost white
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 37 · 37
WGK Germany: 3 · 3
HS Code: 29310099 · 29310099

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 67 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

wgk: 3
hs_code: 29310099
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 37
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313