Benzenamine,2-(1-pyrrolidinyl)-5-(trifluoromethyl)- supplier

Name
N-(2-AMINO-4-TRIFLUOROMETHYLPHENYL)PYRROLIDINE
EINECS
CAS No. 133184-80-2
Article Data5
CAS DataBase
Density 1.28 g/cm³
Solubility
Melting Point 33 °C
Formula C₁₁H₁₃F₃N₂
Boiling Point 315.4 °C at 760 mmHg
Molecular Weight 230.233
Flash Point 144.5 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms N-[2-Amino-4-(trifluoromethyl)phenyl]pyrrolidine;
PSA 29.26000
LogP 3.53400

Benzenamine,2-(1-pyrrolidinyl)-5-(trifluoromethyl)- Specification

The Benzenamine,2-(1-pyrrolidinyl)-5-(trifluoromethyl)-, with the CAS registry number of 133184-80-2, is also known as N-[2-Amino-4-(trifluoromethyl)phenyl]pyrrolidine. Its molecular formula is C₁₁H₁₃F₃N₂ and molecular weight is 230.23. What's more, its IUPAC name is 2-Pyrrolidin-1-yl-5-(trifluoromethyl)aniline.

Physical properties about Benzenamine,2-(1-pyrrolidinyl)-5-(trifluoromethyl)- are: (1)ACD/LogP: 3.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.96; (4)ACD/LogD (pH 7.4): 3.26; (5)ACD/BCF (pH 5.5): 88.44; (6)ACD/BCF (pH 7.4): 176.87; (7)ACD/KOC (pH 5.5): 704.53; (8)ACD/KOC (pH 7.4): 1408.94; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 55.67 cm³; (15)Molar Volume: 179.7 cm³; (16)Surface Tension: 39.5 dyne/cm; (17)Density: 1.28 g/cm³; (18)Flash Point: 144.5 °C; (19)Enthalpy of Vaporization: 55.66 kJ/mol; (20)Boiling Point: 315.4 °C at 760 mmHg; (21)Vapour Pressure: 0.00044 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. During using it, wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)c1cc(c(cc1)N2CCCC2)N
(2) InChI: InChI=1/C11H13F3N2/c12-11(13,14)8-3-4-10(9(15)7-8)16-5-1-2-6-16/h3-4,7H,1-2,5-6,15H2
(3) InChIKey: HPDFKXPVMXSXGE-UHFFFAOYAE

Product Name

N-(2-AMINO-4-TRIFLUOROMETHYLPHENYL)PYRROLIDINE

Benzenamine,2-(1-pyrrolidinyl)-5-(trifluoromethyl)- Specification

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