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CAS No.: | 27917-11-9 |
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Name: | 4-CHLORO-2-METHYLBENZYLAMINE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C8H10ClN |
Molecular Weight: | 155.627 |
Synonyms: | Benzylamine,4-chloro-2-methyl- (8CI);(4-Chloro-2-methylbenzyl)amine;2-Methyl-4-chlorobenzylamine;2-(Aminomethyl)-5-chlorotoluene; |
Density: | 1.13 g/cm3 |
Boiling Point: | 242.8 °C at 760 mmHg |
Flash Point: | 115.9 °C |
Hazard Symbols: | Xi |
Risk Codes: | 34 |
Safety: | 26-36/37/39 |
Transport Information: | 2735 |
PSA: | 26.02000 |
LogP: | 2.80740 |
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The CAS register number of Benzenemethanamine,4-chloro-2-methyl- is 27917-11-9. It also can be called as 2-(Aminomethyl)-5-chlorotoluene and the IUPAC name about this chemical is (4-chloro-2-methylphenyl)methanamine. The molecular formula about this chemical is C8H10ClN and the molecular weight is 155.62.
Physical properties about Benzenemethanamine,4-chloro-2-methyl- are: (1)ACD/LogP: 2.14; (2)ACD/LogD (pH 5.5): -0.86; (3)ACD/LogD (pH 7.4): 0.36; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 5.78; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.558; (13)Molar Refractivity: 44.42 cm3; (14)Molar Volume: 137.6 cm3; (15)Polarizability: 17.61x10-24cm3; (16)Surface Tension: 40.2 dyne/cm; (17)Density: 1.13 g/cm3; (18)Flash Point: 115.9 °C; (19)Enthalpy of Vaporization: 47.98 kJ/mol; (20)Boiling Point: 242.8 °C at 760 mmHg; (21)Vapour Pressure: 0.0332 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns and it may cause inflammation to the skin or other mucous membranes. If you want to use it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(c(cc1)CN)C
(2)InChI: InChI=1/C8H10ClN/c1-6-4-8(9)3-2-7(6)5-10/h2-4H,5,10H2,1H3
(3)InChIKey: WTSJOJUKDNGALK-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C8H10ClN/c1-6-4-8(9)3-2-7(6)5-10/h2-4H,5,10H2,1H3
(5)Std. InChIKey: WTSJOJUKDNGALK-UHFFFAOYSA-N