Isopropyl 4-hydroxypiperidine-1-carboxylate supplier

Name
Isopropyl 4-hydroxypiperidine-1-carboxylate
EINECS
CAS No. 832715-51-2
Article Data10
CAS DataBase
Density 1.131 g/cm³
Solubility
Melting Point
Formula C₉H₁₇NO₃
Boiling Point 283.7 °C at 760 mmHg
Molecular Weight 187.239
Flash Point 125.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Methylethyl4-hydroxy-1-piperidinecarboxylate;4-Hydroxypiperidine-1-carboxylic acidisopropyl ester;Isopropyl 4-hydroxypiperidine-1-carboxylate;1-Piperidinecarboxylic acid, 4-hydroxy-, 1-methylethyl ester;
PSA 49.77000
LogP 0.92600

Isopropyl 4-hydroxypiperidine-1-carboxylate Specification

The Isopropyl 4-hydroxypiperidine-1-carboxylate, with the CAS registry number 832715-51-2, is also called 1-Piperidinecarboxylic acid, 4-hydroxy-, 1-methylethyl ester. It belongs to the product category of Organic acids. And the molecular formula of the chemical is C₉H₁₇NO₃.

The characteristics of Isopropyl 4-hydroxypiperidine-1-carboxylate are as followings: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.26; (4)ACD/LogD (pH 7.4): 0.26; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 33.02; (8)ACD/KOC (pH 7.4): 33.02; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 38.77 Å²; (13)Index of Refraction: 1.496; (14)Molar Refractivity: 48.39 cm³; (15)Molar Volume: 165.5 cm³; (16)Polarizability: 19.18×10^-24cm³; (17)Surface Tension: 43.7 dyne/cm; (18)Density: 1.131 g/cm³; (19)Flash Point: 125.4 °C; (20)Enthalpy of Vaporization: 60.66 kJ/mol; (21)Boiling Point: 283.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000361 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CC(C)OC(=O)N1CCC(CC1)O
(2)InChI: InChI=1/C9H17NO3/c1-7(2)13-9(12)10-5-3-8(11)4-6-10/h7-8,11H,3-6H2,1-2H3
(3)InChIKey: UKVIBHRSFKWRPA-UHFFFAOYAS

Product Name

Isopropyl 4-hydroxypiperidine-1-carboxylate

Isopropyl 4-hydroxypiperidine-1-carboxylate Specification

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