Synonyms: | Cyclohexanol,2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)-, hydrochloride, (1R,2R)- (9CI);Cyclohexanol, 2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)-, hydrochloride,(1R-cis)-;(+)-Tramadol;(+)-trans-Tramadol hydrochloride; |
InChI: | InChI=1/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/t14-,16+/m0/s1 |
Specification: |
The (+)-Tramadol hydrochloride with its cas register number is 148229-78-1. It also can be called as and the Systematic name about this chemical is (1R,2R)-2-[(dimethylamino)methyl]-1-(3-methoxyphenyl)cyclohexanol hydrochloride (1:1). It belongs to the following product categories, such as Intermediates & Fine Chemicals and Pharmaceuticals. This chemical is an Analgesic and it can be used in the treatment of urinary incontinence.
Physical properties about (+)-Tramadol hydrochloride are: (1)ACD/LogP: 2.51; (2)ACD/LogD (pH 5.5): -0.53; (3) ACD/LogD (pH 7.4): 0.49; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 5.24; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 21.7Å2; (12)Enthalpy of Vaporization: 67.22 kJ/mol; (13)Vapour Pressure: 1.02E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O[C@]2(c1cc(OC)ccc1)CCCC[C@@H]2CN(C)C
(2)InChI: InChI=1/C16H25NO2.ClH/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3;/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3;1H/t14-,16+;/m1./s1
(3)InChIKey: PPKXEPBICJTCRU-XMZRARIVBF
(4)Std. InChI: InChI=1S/C16H25NO2.ClH/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3;/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3;1H/t14-,16+;/m1./s1
(5)Std. InChIKey: PPKXEPBICJTCRU-XMZRARIVSA-N
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