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Name	Bethanidine sulfate	EINECS	N/A
CAS No.	114-85-2	Density	N/A
PSA	N/A	LogP	N/A
Solubility	N/A	Melting Point	N/A
Formula	C₂₀H₃₀N₆•H₂O₄S	Boiling Point	282.1°C at 760 mmHg
Molecular Weight	452.64	Flash Point	124.4°C
Transport Information	N/A	Appearance	N/A
Safety	Poison by intraperitoneal, subcutaneous, and intravenous routes. Moderately toxic by ingestion. See also SULFATES. When heated to decomposition it emits toxic fumes of NO_x and SO_x.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	N/A

Bethanidine sulfate Chemical Properties

Product Name: Bethanidine sulfate (CAS NO.114-85-2)

Molecular Formula: C₂₀H₃₀N₆•H₂O₄S
Molecular Weight: 452.64g/mol
Mol File: 114-85-2.mol
Boiling point: 282.1 °C at 760 mmHg
Flash Point: 124.4 °C
Enthalpy of Vaporization: 52.09 kJ/mol
Vapour Pressure: 0.00343 mmHg at 25°C
XLogP3-AA:
H-Bond Donor: 4
H-Bond Acceptor: 8
Structure Descriptors of Bethanidine sulfate (CAS NO.114-85-2):
IUPAC Name: (N-benzyl-N'-methylcarbamimidoyl)-methylazanium sulfate
Canonical SMILES: C[NH2+]C(=NC)NCC1=CC=CC=C1.C[NH2+]C(=NC)NCC1=CC=CC=C1.[O-]S(=O)(=O)[O-]
InChI: InChI=1S/2C10H15N3.H2O4S/c2*1-11-10(12-2)13-8-9-6-4-3-5-7-9;1-5(2,
3)4/h2*3-7H,8H2,1-2H3,(H2,11,12,13);(H2,1,2,3,4)
InChIKey: YTIJUXVIZLYQTB-UHFFFAOYSA-N

Bethanidine sulfate Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
chicken	LDLo	intravenous	100mg/kg (100mg/kg)		British Journal of Pharmacology and Chemotherapy. Vol. 20, Pg. 36, 1963.
mouse	LD50	intraperitoneal	150mg/kg (150mg/kg)		British Journal of Pharmacology and Chemotherapy. Vol. 20, Pg. 36, 1963.
mouse	LD50	intravenous	12mg/kg (12mg/kg)		British Journal of Pharmacology and Chemotherapy. Vol. 20, Pg. 36, 1963.
mouse	LD50	oral	520mg/kg (520mg/kg)		British Journal of Pharmacology and Chemotherapy. Vol. 20, Pg. 36, 1963.
mouse	LD50	subcutaneous	260mg/kg (260mg/kg)		British Journal of Pharmacology and Chemotherapy. Vol. 20, Pg. 36, 1963.
rat	LD50	intravenous	20mg/kg (20mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 72, Pg. 837, 1976.

Bethanidine sulfate Safety Profile

Poison by intraperitoneal, subcutaneous, and intravenous routes. Moderately toxic by ingestion. See also SULFATES. When heated to decomposition it emits toxic fumes of NO_x and SO_x.

Bethanidine sulfate Specification

Bethanidine sulfate ,its CAS NO. is 114-85-2,the synonyms is Regulin ; 1-Benzyl-2,3-dimethylguanidinium sulfate ; BW 467 C-60 ; Batel ; Bendogen ; Bentanidol ; Benzanidine ; Benzoxine ; Betaling ; Bethanidine sulfate ; Bethanidine, hemisulfate ; EINECS 204-056-9 ; Esbatal ; Eusmanid ; Guanidine, N,N'-dimethyl-N"-(phenylmethyl)-, sulfate (2:1) ; Hypersin ; N,N-Dimethyl''-(phenylmethyl)guanidine sulphate (2:1) ; N-Benzyl-N',N''-dimethylguanidine sulfate ; N-Benzyl-N',N''-dimethylguanidine sulphate ; NSC-106563 ; Regulin ; Tenathan ; 1-Benzyl-2,3-dimethylguanidinium sulphate (2:1) ; Guanidine, 1-benzyl-2,3-dimethyl-, sulfate(2:1) .

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