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CAS No.: | 39190-96-0 |
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Name: | N-(4-METHYLBENZYL)-N-PROPYLAMINE |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C11H17N |
Molecular Weight: | 163.263 |
Synonyms: | (p-Methylbenzyl)propylamine;4-Methyl-N-propylbenzylamine; |
Density: | 0.905 g/cm3 |
Boiling Point: | 234.6 °C at 760 mmHg |
Flash Point: | 94.8 °C |
PSA: | 12.03000 |
LogP: | 2.88550 |
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The Benzenemethanamine,4-methyl-N-propyl- is an organic compound with the formula C11H17N. The systematic name of this chemical is (4-methylphenyl)methyl-propylazanium. With the CAS registry number 39190-96-0, it is also named as N-(4-methylbenzyl)-N-propylamine.
Physical properties about Benzenemethanamine,4-methyl-N-propyl- are: (1)ACD/LogP: 3.04; (2)ACD/LogD (pH 5.5): -0.04; (3)ACD/LogD (pH 7.4): 0.56; (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): 3.52; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.504; (13)Molar Refractivity: 53.48 cm3; (14)Molar Volume: 180.3 cm3; (15)Polarizability: 21.2×10-24cm3; (16)Surface Tension: 32 dyne/cm; (17)Density: 0.905 g/cm3; (18)Flash Point: 94.8 °C; (19)Enthalpy of Vaporization: 47.14 kJ/mol; (20)Boiling Point: 234.6 °C at 760 mmHg; (21)Vapour Pressure: 0.0524 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N(CCC)Cc1ccc(cc1)C
(2)InChI: InChI=1/C11H17N/c1-3-8-12-9-11-6-4-10(2)5-7-11/h4-7,12H,3,8-9H2,1-2H3
(3)InChIKey: KEPDRVSVMRMGCR-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C11H17N/c1-3-8-12-9-11-6-4-10(2)5-7-11/h4-7,12H,3,8-9H2,1-2H3
(5)Std. InChIKey: KEPDRVSVMRMGCR-UHFFFAOYSA-N