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CAS No.: | 771572-29-3 |
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Name: | 3-(Aminomethyl)-5-methyl-2-phenylfuran |
Molecular Structure: | |
Formula: | C12H13NO |
Molecular Weight: | 187.241 |
Synonyms: | (5-Methyl-2-phenyl-3-furyl)methylamine;3-(Aminomethyl)-5-methyl-2-phenylfuran;3-(Aminomethyl)-5-methyl-2-phenylfuran 97%;(5-Methyl-2-phenylfur-3-yl)methylamine;(5-Methyl-2-phenyl-3-furyl)MethanaMine |
Density: | 1.077 g/cm3 |
Boiling Point: | 301.5 °C at 760 mmHg |
Flash Point: | 136.2 °C |
Hazard Symbols: | C |
PSA: | 39.16000 |
LogP: | 3.41400 |
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The 3-Furanmethanamine,5-methyl-2-phenyl- is an organic compound with the formula C12H13NO. The systematic name of this chemical is (5-methyl-2-phenyl-3-furyl)methanamine. With the CAS registry number 771572-29-3, it is also named as 3-(Aminomethyl)-5-methyl-2-phenylfuran.
Physical properties about 3-Furanmethanamine,5-methyl-2-phenyl- are: (1)ACD/LogP: 2.50; (2)ACD/LogD (pH 7.4): 1; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 39.16 Å2; (7)Index of Refraction: 1.562; (8)Molar Refractivity: 56.42 cm3; (9)Molar Volume: 173.7 cm3; (10)Polarizability: 22.36×10-24cm3; (11)Surface Tension: 40.3 dyne/cm; (12)Density: 1.077 g/cm3; (13)Flash Point: 136.2 °C; (14)Enthalpy of Vaporization: 54.17 kJ/mol; (15)Boiling Point: 301.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00105 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(c(o1)c2ccccc2)CN
(2)InChI: InChI=1/C12H13NO/c1-9-7-11(8-13)12(14-9)10-5-3-2-4-6-10/h2-7H,8,13H2,1H3
(3)InChIKey: PQZVRVFUCJMCRZ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C12H13NO/c1-9-7-11(8-13)12(14-9)10-5-3-2-4-6-10/h2-7H,8,13H2,1H3
(5)Std. InChIKey: PQZVRVFUCJMCRZ-UHFFFAOYSA-N