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| CAS No.: | 951-87-1 |
|---|---|
| Name: | meso-1,2-Diphenylethylenediamine |
| Molecular Structure: | |
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| Formula: | C14H16N2 |
| Molecular Weight: | 212.294 |
| Synonyms: | 1,2-Ethanediamine,1,2-diphenyl-, (R*,S*)-;Ethylenediamine, 1,2-diphenyl-, meso- (8CI);(1R,2S)-Diaminodiphenylethane;NSC 180201;meso-1,2-Diamino-1,2-diphenylethane;meso-1,2-Diphenyl-1,2-ethanediamine;meso-1,2-Diphenyl-1,2-ethylenediamine;meso-1,2-Diphenyldiaminoethane;meso-1,2-Diphenylethylenediamine;meso-Stilbenediamine; |
| Density: | 1.106 g/cm3 |
| Melting Point: | 118-122°C |
| Boiling Point: | 353.9 °C at 760 mmHg |
| Flash Point: | 199.9 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 52.04000 |
| LogP: | 3.78700 |
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Specification
This chemical is called meso-1,2-Diphenylethylenediamine, and its systematic name is (1R,2S)-1,2-diphenylethane-1,2-diamine. With the molecular formula of C14H16N2, its molecular weight is 212.29. The CAS registry number of this chemical is 951-87-1. Additionally, its product categories are Nitrogen Compounds; Organic Building Blocks; Polyamines.
Other characteristics of the meso-1,2-Diphenylethylenediamine can be summarised as followings: (1)ACD/LogP: 1.60; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 6.48 Å2; (7)Index of Refraction: 1.619; (8)Molar Refractivity: 67.36 cm3; (9)Molar Volume: 191.8 cm3; (10)Polarizability: 26.7×10-24cm3; (11)Surface Tension: 50.5 dyne/cm; (12)Density: 1.106 g/cm3; (13)Flash Point: 199.9 °C; (14)Enthalpy of Vaporization: 59.89 kJ/mol; (15)Boiling Point: 353.9 °C at 760 mmHg; (16)Vapour Pressure: 3.48E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: N[C@H](c1ccccc1)[C@H](c2ccccc2)N
2.InChI: InChI=1/C14H16N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,15-16H2/t13-,14+
3.InChIKey: PONXTPCRRASWKW-OKILXGFUBS