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Name
[3-[(4-METHYLPIPERIDINO)METHYL]PHENYL]METHANAMINE
- EINECS
- CAS No. 690632-06-5
- Density 1.011 g/cm3
- Solubility
- Melting Point
- Formula C14H22N2
- Boiling Point 322.2 °C at 760 mmHg
- Molecular Weight 218.342
- Flash Point 137.6 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
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Hazard Symbols
C
- Synonyms 3-[(4-METHYLPIPERIDINO)METHYL]BENZYLAMINE;[3-[(4-METHYLPIPERIDINO)METHYL]PHENYL]METHANAMINE;AKOS B025015;1-[3-[(4-METHYLPIPERIDIN-1-YL)METHYL]PHENYL]METHANAMINE;ART-CHEM-BB B025015;{3-[(4-Methylpiperidino)methyl]phenyl}methaneamine;3-(4-Methylpiperidin-1-yl)methylbenzylamine 97%;3-(4-Methylpiperidin-1-yl)methylbenzylamine
- PSA 29.26000
- LogP 3.01540
Benzenemethanamine, 3-[(4-methyl-1-piperidinyl)methyl]- Specification
This chemical is called Benzenemethanamine, 3-[(4-methyl-1-piperidinyl)methyl]-, and its systematic name is 1-{3-[(4-methylpiperidin-1-yl)methyl]phenyl}methanamine. With the molecular formula of C14H22N2, its molecular weight is 218.34. The CAS registry number of this chemical is 690632-06-5.
Other characteristics of the Benzenemethanamine, 3-[(4-methyl-1-piperidinyl)methyl]- can be summarised as followings: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.98; (4)ACD/LogD (pH 7.4): -1.16; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 68.95 cm3; (15)Molar Volume: 215.7 cm3; (16)Polarizability: 27.33×10-24cm3; (17)Surface Tension: 41.2 dyne/cm; (18)Density: 1.011 g/cm3; (19)Flash Point: 137.6 °C; (20)Enthalpy of Vaporization: 56.4 kJ/mol; (21)Boiling Point: 322.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000284 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1c(cccc1CN)CN2CCC(CC2)C
2.InChI: InChI=1/C14H22N2/c1-12-5-7-16(8-6-12)11-14-4-2-3-13(9-14)10-15/h2-4,9,12H,5-8,10-11,15H2,1H3
3.InChIKey: ZULQRDYUOOXCFV-UHFFFAOYAU
Related Products
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- Benzenemethanamine, 3-[(4-methyl-1-piperidinyl)methyl]-
- Benzenemethanamine, 3-[3-(dimethylamino)propoxy]-
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