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Name |
3,2'-Dimethyl-4-nitrosobiphenyl |
EINECS | N/A |
CAS No. | 70786-64-0 | Density | 1.05 g/cm3 |
PSA | 29.43000 | LogP | 4.36830 |
Solubility | N/A | Melting Point |
N/A |
Formula | C14H13NO | Boiling Point | 331.2 °C at 760 mmHg |
Molecular Weight | 211.263 | Flash Point | 135.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3,2'-Dimethyl-4-nitrosobiphenyl; |
This chemical is called 3,2'-Dimethyl-4-nitrosobiphenyl, and its systematic name is 2,3'-dimethyl-4'-nitrosobiphenyl. With the molecular formula of C14H13NO, its molecular weight is 211.26. The CAS registry number of this chemical is 70786-64-0, and its classification codes are Mutation data; Tumor data.
Other characteristics of the 3,2'-Dimethyl-4-nitrosobiphenyl can be summarised as followings: (1)ACD/LogP: 5.06; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.06; (4)ACD/LogD (pH 7.4): 5.06; (5)ACD/BCF (pH 5.5): 4116.24; (6)ACD/BCF (pH 7.4): 4116.24; (7)ACD/KOC (pH 5.5): 13454.06; (8)ACD/KOC (pH 7.4): 13454.06; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.43 Å2; (13)Index of Refraction: 1.564; (14)Molar Refractivity: 65.5 cm3; (15)Molar Volume: 201.1 cm3; (16)Polarizability: 25.96×10-24cm3; (17)Surface Tension: 36.8 dyne/cm; (18)Density: 1.05 g/cm3; (19)Flash Point: 135.9 °C; (20)Enthalpy of Vaporization: 55.11 kJ/mol; (21)Boiling Point: 331.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000304 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=Nc1ccc(cc1C)c2ccccc2C
2.InChI: InChI=1/C14H13NO/c1-10-5-3-4-6-13(10)12-7-8-14(15-16)11(2)9-12/h3-9H,1-2H3
3.InChIKey: CKEUKHXGPKXTTF-UHFFFAOYAO