CAS No.343-27-1,Harmine hydrochloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	343-27-1
Name:	Harmine hydrochloride

Formula:	C₁₃H₁₃ClN₂O
Molecular Weight:	248.71
Synonyms:	9H-Pyrido[3,4-b]indole,7-methoxy-1-methyl-, monohydrochloride (8CI,9CI);7-Methoxy-1-methyl-9H-pyrido[3,4-b]indolemonohydrochloride;Harmine monohydrochloride;
EINECS:	206-443-8
Melting Point:	265-270 °C
Boiling Point:	421.4 °C at 760 mmHg
Flash Point:	139.8 °C
Appearance:	yellow to slightly green crystalline powder
Hazard Symbols:	Xn
Risk Codes:	20/21/22-40
Safety:	22-36
Transport Information:	UN 1544
PSA:	37.91000
LogP:	3.83510

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Specification

The Harmine hydrochloride, with the CAS registry number of 343-27-1, is also known as 7-Methoxy-1-methyl-9H-pyrido(monohydrochloride) and Harminemonohydrochloride. It belongs to the product categories of Alkaloids; Biochemistry; Indole Alkaloids. Its EINECS registry number is 206-443-8. This chemical's molecular formula is C₁₃H₁₃ClN₂O and molecular weight is 248.71. What's more, its IUPAC name is 7-Methoxy-1-methyl-9H-pyrido[3, 4-b]indole hydrochloride. This chemical's classification codes are Drug / Therapeutic Agent; Mutation Data.

Physical properties about Harmine hydrochloride are: (1)ACD/LogP: 3.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.75; (4)ACD/LogD (pH 7.4): 1.87; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 7.53; (7)ACD/KOC (pH 5.5): 4.79; (8)ACD/KOC (pH 7.4): 62.87; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12 Å²; (13)Flash Point: 139.8 °C; (14)Enthalpy of Vaporization: 64.92 kJ/mol; (15)Boiling Point: 421.4 °C at 760 mmHg; (16)Vapour Pressure: 6.42E-07 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. In addition, the dust of this chemical can not be breathed. During using it, wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1) SMILES: [Cl-].O(c1ccc2c(c1)[nH+]c3c2ccnc3C)C
(2) InChI: InChI=1/C13H12N2O.ClH/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;/h3-7,15H,1-2H3;1H
(3) InChIKey: VNPLYCKZIUTKJM-UHFFFAOYAE

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intravenous	38mg/kg (38mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 79, Pg. 127, 1943.