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CAS No.: | 138022-04-5 |
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Name: | TERT-BUTYL METHYL(PIPERIDIN-4-YLMETHYL)-CARBAMATE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C12H24N2O2 |
Molecular Weight: | 228.335 |
Synonyms: | carbamic acid, N-methyl-N-(4-piperidinylmethyl)-, 1,1-dimethylethyl ester; |
Density: | 0.978 g/cm3 |
Boiling Point: | 306.014 °C at 760 mmHg |
Flash Point: | 138.873 °C |
Hazard Symbols: | |
Risk Codes: | Xi:; "> Xi:; |
Safety: | 26 |
PSA: | 41.57000 |
LogP: | 2.18170 |
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The tert-Butyl methyl(piperidin-4-ylmethyl)carbamate with the cas number 138022-04-5 is also called carbamic acid, N-methyl-N-(4-piperidinylmethyl)-, 1,1-dimethylethyl ester. Its molecular formula is C12H24N2O2. This chemical is irritant. While using this chemical, you should be very cautious.
The properties of the chemical are: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 41.57 Å2; (11)Index of Refraction: 1.464; (12)Molar Refractivity: 64.36 cm3; (13)Molar Volume: 233.376 cm3; (14)Polarizability: 25.514×10-24cm3; (15)Surface Tension: 33.529 dyne/cm; (16)Enthalpy of Vaporization: 54.65 kJ/mol; (17)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N(C)CC1CCNCC1
(2)InChI: InChI=1/C12H24N2O2/c1-12(2,3)16-11(15)14(4)9-10-5-7-13-8-6-10/h10,13H,5-9H2,1-4H3
(3)InChIKey: ZREUHPKGCXOWCK-UHFFFAOYAY