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| CAS No.: | 921939-04-0 |
|---|---|
| Name: | 4-{4-[(Methylamino)methyl]piperidin-1-yl}thieno[3,2-d]pyrimidine |
| Molecular Structure: | |
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| Formula: | C13H18N4S |
| Molecular Weight: | 262.37382 |
| Synonyms: | 4-{4-[(Methylamino)methyl]piperidin-1-yl}thieno[3,2-d]pyrimidine;N-Methyl-(1-thieno[3,2-d]pyrimidin-4-ylpiperid-4-yl)methylamine;4-{4-[(Methylamino)methyl]piperidin-1-yl}thieno[3,2-d]pyrimidine 97%;4-{4-[(Methylamino)methyl]piperidin-1-yl}thieno[3,2-d]pyrimidine, 4-[(Methylamino)methyl]-1-(thieno[3,2-d]pyrimidin-4-yl)piperidine;N-Methyl-1-[1-(thieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]methylamine 97% |
| Density: | 1.202 g/cm3 |
| Boiling Point: | 421.4 °C at 760 mmHg |
| Flash Point: | 208.6 °C |
| Hazard Symbols: | C |
| PSA: | 69.29000 |
| LogP: | 2.58300 |
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Specification
The 4-Piperidinemethanamine,N-methyl-1-thieno[3,2-d]pyrimidin-4-yl-, with CAS registry number 921939-04-0, has the systematic name of N-methyl-1-(1-thieno[3,2-d]pyrimidin-4-yl-4-piperidyl)methanamine. Besides this, it is also called 4-{4-[(Methylamino)methyl]piperidin-1-yl}thieno[3,2-d]pyrimidine. This chemical is corrosive. And the chemical formula of this chemical is C13H18N4S.
Physical properties of 4-Piperidinemethanamine,N-methyl-1-thieno[3,2-d]pyrimidin-4-yl-: (1)ACD/LogP: 2.37; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 69.29 Å2; (7)Index of Refraction: 1.617; (8)Molar Refractivity: 76.4 cm3; (9)Molar Volume: 218.1 cm3; (10)Polarizability: 30.28×10-24cm3; (11)Surface Tension: 52.8 dyne/cm; (12)Density: 1.202 g/cm3; (13)Flash Point: 208.6 °C; (14)Enthalpy of Vaporization: 67.54 kJ/mol; (15)Boiling Point: 421.4 °C at 760 mmHg; (16)Vapour Pressure: 2.62E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CNCC1CCN(CC1)c2c3c(ccs3)ncn2
(2)InChI: InChI=1/C13H18N4S/c1-14-8-10-2-5-17(6-3-10)13-12-11(4-7-18-12)15-9-16-13/h4,7,9-10,14H,2-3,5-6,8H2,1H3
(3)InChIKey: WDLUKYARQVQMCZ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C13H18N4S/c1-14-8-10-2-5-17(6-3-10)13-12-11(4-7-18-12)15-9-16-13/h4,7,9-10,14H,2-3,5-6,8H2,1H3
(5)Std. InChIKey: WDLUKYARQVQMCZ-UHFFFAOYSA-N