Acetamide,2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-,rel- CAS NO.2787-09-9

The CAS register number of Acetamide,2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-,rel- is 2787-09-9. It also can be called as Synthomycin and the IUPAC name about this chemical is 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-. The molecular formula about this chemical is C₁₁H₁₂Cl₂N₂O₅ and the molecular weight is 323.13.

Physical properties about Acetamide,2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-,rel- are: (1)ACD/LogP: 1.10; (2)ACD/LogD (pH 5.5): 1.103; (3)ACD/LogD (pH 7.4): 1.102; (4)ACD/BCF (pH 5.5): 4.055; (5)ACD/BCF (pH 7.4): 4.053; (6)ACD/KOC (pH 5.5): 94.796; (7)ACD/KOC (pH 7.4): 94.754; (8)#H bond acceptors: 7; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 8; (11)Polar Surface Area: 115.38 Å²; (12)Index of Refraction: 1.612; (13)Molar Refractivity: 72.559 cm³; (14)Molar Volume: 208.831 cm³; (15)Polarizability: 28.765x10^-24cm³; (16)Surface Tension: 66.124 dyne/cm; (17)Density: 1.547 g/cm³; (18)Flash Point: 343.831 °C; (19)Enthalpy of Vaporization: 99.983 kJ/mol; (20)Boiling Point: 644.913 °C at 760 mmHg.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause cancer and it that at low level cause damage to health. So, If you want to use it, obtain special instructions before use and avoid exposure. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-] 
(2)InChI: InChI=1/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1 
(3)InChIKey: WIIZWVCIJKGZOK-RKDXNWHRBM 
(4)Std. InChI: InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1
(5)Std. InChIKey: WIIZWVCIJKGZOK-RKDXNWHRSA-N

The CAS register number of Acetamide,2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-,rel- is 2787-09-9. It also can be called as Synthomycin and the IUPAC name about this chemical is 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-. The molecular formula about this chemical is C₁₁H₁₂Cl₂N₂O₅ and the molecular weight is 323.13.

Physical properties about Acetamide,2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-,rel- are: (1)ACD/LogP: 1.10; (2)ACD/LogD (pH 5.5): 1.103; (3)ACD/LogD (pH 7.4): 1.102; (4)ACD/BCF (pH 5.5): 4.055; (5)ACD/BCF (pH 7.4): 4.053; (6)ACD/KOC (pH 5.5): 94.796; (7)ACD/KOC (pH 7.4): 94.754; (8)#H bond acceptors: 7; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 8; (11)Polar Surface Area: 115.38 Å²; (12)Index of Refraction: 1.612; (13)Molar Refractivity: 72.559 cm³; (14)Molar Volume: 208.831 cm³; (15)Polarizability: 28.765x10^-24cm³; (16)Surface Tension: 66.124 dyne/cm; (17)Density: 1.547 g/cm³; (18)Flash Point: 343.831 °C; (19)Enthalpy of Vaporization: 99.983 kJ/mol; (20)Boiling Point: 644.913 °C at 760 mmHg.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause cancer and it that at low level cause damage to health. So, If you want to use it, obtain special instructions before use and avoid exposure. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-] 
(2)InChI: InChI=1/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1 
(3)InChIKey: WIIZWVCIJKGZOK-RKDXNWHRBM 
(4)Std. InChI: InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1
(5)Std. InChIKey: WIIZWVCIJKGZOK-RKDXNWHRSA-N