-
Name
4-Hydroxy-4-(2-propenyl)piperidine-1-carboxylic acid tert-butyl ester
- EINECS
- CAS No. 203662-51-5
- Article Data24
- CAS DataBase
- Density 1.053 g/cm3
- Solubility
- Melting Point
- Formula C13H23NO3
- Boiling Point 318.135 °C at 760 mmHg
- Molecular Weight 241.33
- Flash Point 146.203 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 4-Hydroxy-4-(2-propenyl)piperidine-1-carboxylic acid tert-butyl ester;tert-butyl 4-allyl-4-hydroxypiperidine-1-carboxylate;1-Piperidinecarboxylic acid, 4-hydroxy-4-(2-propen-1-yl)-, 1,1-diMethylethyl ester;1-Piperidinecarboxylic acid, 4-hydroxy-4-(2-propenyl)-, 1,1-diMethylethyl ester;4-Allyl-1-Boc-4-hydroxypiperidine;1-Boc-4-allyl-4-hydroxypiperidine
- PSA 49.77000
- LogP 2.26240
tert-Butyl 4-allyl-4-hydroxypiperidine-1-carboxylate Specification
The tert-Butyl 4-allyl-4-hydroxypiperidine-1-carboxylate, with the CAS registry number 203662-51-5, has the systematic name of tert-butyl 4-hydroxy-4-(prop-2-en-1-yl)piperidine-1-carboxylate. It belongs to the product category of Pharmacetical. And the molecular formula of the chemical is C13H23NO3.
The characteristics of tert-Butyl 4-allyl-4-hydroxypiperidine-1-carboxylate are as followings: (1)ACD/LogP: 2.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 16; (6)ACD/BCF (pH 7.4): 16; (7)ACD/KOC (pH 5.5): 254; (8)ACD/KOC (pH 7.4): 254; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 49.77 Å2; (13)Index of Refraction: 1.493; (14)Molar Refractivity: 66.621 cm3; (15)Molar Volume: 229.288 cm3; (16)Polarizability: 26.41×10-24cm3; (17)Surface Tension: 38.663 dyne/cm; (18)Density: 1.053 g/cm3; (19)Flash Point: 146.203 °C; (20)Enthalpy of Vaporization: 64.873 kJ/mol; (21)Boiling Point: 318.135 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1CCC(O)(CC1)CC=C
(2)InChI: InChI=1/C13H23NO3/c1-5-6-13(16)7-9-14(10-8-13)11(15)17-12(2,3)4/h5,16H,1,6-10H2,2-4H3
(3)InChIKey: BWHACQPKDGMQIK-UHFFFAOYAR
Related Products
- tert-Butyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
- tert-Butyl (1-formylcyclopropyl)carbamate
- tert-Butyl (1-hydroxy-3-phenylpropan-2-yl)carbamate
- tert-Butyl (1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-carboxylate
- tert-Butyl (2-aminophenyl)carbamate
- tert-Butyl (2-chloro-3-formylpyridin-4-yl)carbamate
- tert-Butyl (2R)-2-(hydroxymethyl)-5-oxopyrrolidine-1-carboxylate
- tert-Butyl (2R,3S)-(-)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate
- tert-Butyl (2S)-2-(hydroxymethyl)-5-oxopyrrolidine-1-carboxylate
- tert-Butyl (2S)-2-carbamoyl-2,3-dihydropyrrole-1-carboxylate
- 2036-62-6
- 20368-24-5
- 203-68-9
- 203714-71-0
- 203716-99-8
- 20372-63-8
- 2037-26-5
- 2037-31-2
- 20373-91-5
- 20374-46-3
Hot Products
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View