Benzenemethanamine,N-methyl-2-(2-thienyl)- supplier

Name
N-METHYL-N-(2-THIEN-2-YLBENZYL)AMINE
EINECS
CAS No. 852180-66-6
Density 1.094 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₃NS
Boiling Point 321.7 °C at 760 mmHg
Molecular Weight 203.3
Flash Point 148.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols C
Synonyms N-Methyl-N-(2-thien-2-ylbenzyl)amine;
PSA 40.27000
LogP 3.52540

Benzenemethanamine,N-methyl-2-(2-thienyl)- Specification

The Benzenemethanamine,N-methyl-2-(2-thienyl)-, with the CAS registry number 852180-66-6, is also known as N-Methyl-N-(2-thien-2-ylbenzyl)amine. This chemical's molecular formula is C₁₂H₁₃NS and molecular weight is 203.3. What's more, its systematic name is called N-Methyl-1-(2-thiophen-2-ylphenyl)methanamine. When you are dealing with this chemical, you should be very careful. This chemical may destroy living tissue on contact.

Physical properties about Benzenemethanamine,N-methyl-2-(2-thienyl)- are: (1) ACD/LogP: 3.08; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 0.03; (4) ACD/LogD (pH 7.4): 1.02; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1.11; (7) ACD/KOC (pH 5.5): 1.01; (8) ACD/KOC (pH 7.4): 9.73; (9) #H bond acceptors: 1; (10) #H bond donors: 1; (11) #Freely Rotating Bonds: 3; (12) Polar Surface Area: 31.48 Å²; (13) Index of Refraction: 1.586; (14) Molar Refractivity: 62.37 cm³; (15) Molar Volume: 185.8 cm³; (16) Surface Tension: 40.3 dyne/cm; (17) Density: 1.094 g/cm³; (18) Flash Point: 148.4 °C; (19) Enthalpy of Vaporization: 56.35 kJ/mol; (20) Boiling Point: 321.7 °C at 760 mmHg; (21) Vapour Pressure: 0.000293 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: s2c(c1c(cccc1)CNC)ccc2
(2) InChI: InChI=1/C12H13NS/c1-13-9-10-5-2-3-6-11(10)12-7-4-8-14-12/h2-8,13H,9H2,1H3
(3) InChIKey: MRKJJEJYTBOUTH-UHFFFAOYAX

Product Name

N-METHYL-N-(2-THIEN-2-YLBENZYL)AMINE

Benzenemethanamine,N-methyl-2-(2-thienyl)- Specification

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