CAS No.70749-06-3,(1S,2S)-(-)-N,N'-DIMETHYL-1,2-DIPHENYL-1,2-ETHANE DIAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	70749-06-3
Name:	(1S,2S)-(-)-N,N'-DIMETHYL-1,2-DIPHENYL-1,2-ETHANE DIAMINE
Article Data:	17

Formula:	C₁₆H₂₀N₂
Molecular Weight:	240.348
Synonyms:	1,2-Ethanediamine,N,N'-dimethyl-1,2-diphenyl-, [S-(R,R)]-;(1S,2S)-(-)-N,N'-Dimethyl-1,2-diphenyl-1,2-ethanediamine;(1S,2S)-N,N'-Dimethyl-1,2-diphenyl-1,2-ethanediamine;(1S,2S)-N,N'-Dimethyl-1,2-diphenylethylenediamine;
Density:	1.0485 (rough estimate)
Melting Point:	48-51 °C
Boiling Point:	346.4 °C at 760 mmHg
Flash Point:	193.9 °C
Appearance:	white to light yellow crystals or crystalline powder
Hazard Symbols:	C
Risk Codes:	34
Safety:	45-36/37/39-26
PSA:	24.06000
LogP:	3.68960

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Specification

The 1,2-Ethanediamine,N,N'-dimethyl-1,2-diphenyl-, (1S,2S)-, with the CAS registry number 70749-06-3, belongs to the product category of Chiral Compound. This chemical's molecular formula is C₁₆H₂₀N₂ and molecular weight is 240.34. Its systematic name is called (1S,2S)-N,N'-dimethyl-1,2-diphenylethane-1,2-diaminium. You should store it in a tightly-sealed container in a cool and dry place (0-6℃) which is white to light yellow crystals or crystalline powder.

Physical properties of 1,2-Ethanediamine,N,N'-dimethyl-1,2-diphenyl-, (1S,2S)-: (1)ACD/LogP: 3.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.01; (4)ACD/LogD (pH 7.4): 1.37; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2.48; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 21.47; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Flash Point: 193.9 °C; (13)Enthalpy of Vaporization: 59.05 kJ/mol; (14)Boiling Point: 346.4 °C at 760 mmHg; (15)Vapour Pressure: 5.78E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact and may cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: c1(ccccc1)[C@@H]([C@H](c2ccccc2)[NH2+]C)[NH2+]
(2)InChI: InChI=1/C16H20N2/c1-17-15(13-9-5-3-6-10-13)16(18-2)14-11-7-4-8-12-14/h3-12,15-18H,1-2H3/p+2/t15-,16-/m0/s1
(3)InChIKey: BTHYVQUNQHWNLS-SIFSQGPGBG