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CAS No.: | 13533-32-9 |
---|---|
Name: | 4-bromo-N-[(E)-thiophen-2-ylmethylidene]aniline |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C11H8BrNS |
Molecular Weight: | 266.161 |
Synonyms: | Aniline,p-bromo-N-2-thenylidene- (7CI,8CI);NSC 306941;N-(4-Bromophenyl)-1-thiophen-2-ylmethanimine; |
Density: | 1.44 g/cm3 |
Boiling Point: | 368.2 °C at 760 mmHg |
Flash Point: | 176.5 °C |
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The Benzenamine, 4-bromo-N-(2-thienylmethylene)-, with the CAS registry number 13533-32-9, is also known as Aniline,p-bromo-N-2-thenylidene- (7CI,8CI). This chemical's molecular formula is C11H8BrNS and molecular weight is 266.16. What's more, its IUPAC name is N-(4-bromophenyl)-1-thiophen-2-ylmethanimine.
Physical properties of Benzenamine, 4-bromo-N-(2-thienylmethylene)- are: (1)ACD/LogP: 3.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 40.6 Å2; (7)Index of Refraction: 1.641; (8)Molar Refractivity: 66.56 cm3; (9)Molar Volume: 184.3 cm3; (10)Polarizability: 26.38×10-24cm3; (11)Surface Tension: 46.7 dyne/cm; (12)Density: 1.44 g/cm3; (13)Flash Point: 176.5 °C; (14)Enthalpy of Vaporization: 59.07 kJ/mol; (15)Boiling Point: 368.2 °C at 760 mmHg; (16)Vapour Pressure: 2.74E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CSC(=C1)C=NC2=CC=C(C=C2)Br
(2)InChI: InChI=1S/C11H8BrNS/c12-9-3-5-10(6-4-9)13-8-11-2-1-7-14-11/h1-8H
(3)InChIKey: SMGZHXZRKPSNHB-UHFFFAOYSA-N