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Benzenamine, 3-(2-thienyl)-

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Name

Benzenamine, 3-(2-thienyl)-

EINECS N/A
CAS No. 92057-12-0 Density 1.196 g/cm3
PSA 54.26000 LogP 3.57850
Solubility N/A Melting Point 246 °C
Formula C10H9NS Boiling Point 341.6 °C at 760 mmHg
Molecular Weight 175.254 Flash Point 160.4 °C
Transport Information N/A Appearance N/A
Safety 45 Risk Codes 25
Molecular Structure Molecular Structure of 92057-12-0 (3-(2-THIENYL)ANILINE) Hazard Symbols IrritantXi
Synonyms

Aniline,m-2-thienyl- (6CI,7CI);2-(3-Aminophenyl)thiophene;3-(2-Thienyl)aniline;3-(Thiophen-2-yl)aniline;[3-(Thiophen-2-yl)phenyl]amine;

Article Data 3

Benzenamine, 3-(2-thienyl)- Specification

This chemical is called Benzenamine, 3-(2-thienyl)-, and its systematic name is 3-thiophen-2-ylaniline. With the molecular formula of C10H9NS, its molecular weight is 175.25. The CAS registry number of this chemical is 92057-12-0.

Other characteristics of the Benzenamine, 3-(2-thienyl)- can be summarised as followings: (1)ACD/LogP: 2.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.2; (4)ACD/LogD (pH 7.4): 2.22; (5)ACD/BCF (pH 5.5): 27.61; (6)ACD/BCF (pH 7.4): 28.66; (7)ACD/KOC (pH 5.5): 370.23; (8)ACD/KOC (pH 7.4): 384.3; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 31.48 Å2; (13)Index of Refraction: 1.65; (14)Molar Refractivity: 53.46 cm3; (15)Molar Volume: 146.4 cm3; (16)Polarizability: 21.19×10-24cm3; (17)Surface Tension: 50 dyne/cm; (18)Density: 1.196 g/cm3; (19)Flash Point: 160.4 °C; (20)Enthalpy of Vaporization: 58.52 kJ/mol; (21)Boiling Point: 341.6 °C at 760 mmHg; (22)Vapour Pressure: 7.98E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: s2c(c1cc(ccc1)N)ccc2
2.InChI: InChI=1/C10H9NS/c11-9-4-1-3-8(7-9)10-5-2-6-12-10/h1-7H,11H2
3.InChIKey: YUTPSMJOCLLMBK-UHFFFAOYAZ

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