1,3-diaminoadamanta...

1,3-diaminoadamantane dihydrochloride

1,3-diaminoadamantane dihydrochloride

Min.Order / FOB Price:Get Latest Price

100 Gram

FOB Price: USD 300.0000

  • Min.Order :100 Gram
  • Purity: 98%
  • Payment Terms : T/T,

Keywords

26562-81-2 adamantane amino

Quick Details

  • Appearance:offwhite crystal
  • Application: 26562-81-2
  • PackAge:25kg
  • ProductionCapacity:2|Metric Ton|Month
  • Storage:AMB
  • Transportation:26562-81-2

Superiority:

The IUPAC name of 1,3-Diaminoadamantane dihydrochloride is Adamantane-1,3-diamine dihydrochloride. With the CAS registry number 26562-81-2, it is also named as Tricyclo[3.3.1.13,7]decane-1,3-diamine,hydrochloride (1:2). The product's classification code is Drug / Therapeutic Agent. In addition, its molecular formula is C10H20Cl2N2 and its molecular weight is 405.45. 

The other characteristics of 1,3-Diaminoadamantane dihydrochloride can be summarized as: (1)H-Bond Donor: 4; (2)H-Bond Acceptor: 2; (3)Rotatable Bond Count: 0; (4)Exact Mass: 238.100354; (5)MonoIsotopic Mass: 238.100354; (6)Topological Polar Surface Area: 52; (7)Heavy Atom Count: 14; (8)Complexity: 190; (9)Covalently-Bonded Unit Count: 3; (10)Freely Rotating Bonds: 2; (11)Flash Point: 122 °C; (12)Enthalpy of Vaporization: 48.58 kJ/mol; (13)Boiling Point: 248.6 °C at 760 mmHg; (14)Vapour Pressure: 0.0241 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Cl.Cl.NC13CC2CC(N)(CC(C1)C2)C3
(2)InChI:InChI=1/C10H18N2.2ClH/c11-9-2-7-1-8(4-9)5-10(12,3-7)6-9;;/h7-8H,1-6,11-12H2;2*1H
(3)InChIKey:JFXXSCYTYFTSNO-UHFFFAOYAH
(4)Std. InChI:InChI=1S/C10H18N2.2ClH/c11-9-2-7-1-8(4-9)5-10(12,3-7)6-9;;/h7-8H,1-6,11-12H2;2*1H
(5)Std. InChIKey:JFXXSCYTYFTSNO-UHFFFAOYSA-N

The toxicity data is as follows:

 

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 785mg/kg (785mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 92, 1996.

 

Details:

The IUPAC name of 1,3-Diaminoadamantane dihydrochloride is Adamantane-1,3-diamine dihydrochloride. With the CAS registry number 26562-81-2, it is also named as Tricyclo[3.3.1.13,7]decane-1,3-diamine,hydrochloride (1:2). The product's classification code is Drug / Therapeutic Agent. In addition, its molecular formula is C10H20Cl2N2 and its molecular weight is 405.45. 

The other characteristics of 1,3-Diaminoadamantane dihydrochloride can be summarized as: (1)H-Bond Donor: 4; (2)H-Bond Acceptor: 2; (3)Rotatable Bond Count: 0; (4)Exact Mass: 238.100354; (5)MonoIsotopic Mass: 238.100354; (6)Topological Polar Surface Area: 52; (7)Heavy Atom Count: 14; (8)Complexity: 190; (9)Covalently-Bonded Unit Count: 3; (10)Freely Rotating Bonds: 2; (11)Flash Point: 122 °C; (12)Enthalpy of Vaporization: 48.58 kJ/mol; (13)Boiling Point: 248.6 °C at 760 mmHg; (14)Vapour Pressure: 0.0241 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Cl.Cl.NC13CC2CC(N)(CC(C1)C2)C3
(2)InChI:InChI=1/C10H18N2.2ClH/c11-9-2-7-1-8(4-9)5-10(12,3-7)6-9;;/h7-8H,1-6,11-12H2;2*1H
(3)InChIKey:JFXXSCYTYFTSNO-UHFFFAOYAH
(4)Std. InChI:InChI=1S/C10H18N2.2ClH/c11-9-2-7-1-8(4-9)5-10(12,3-7)6-9;;/h7-8H,1-6,11-12H2;2*1H
(5)Std. InChIKey:JFXXSCYTYFTSNO-UHFFFAOYSA-N

The toxicity data is as follows:

 

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 785mg/kg (785mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 92, 1996.

 

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