N-Boc-4-iodopiperidine supplier

Name
N-Boc-4-iodopiperidine
EINECS 690-647-0
CAS No. 301673-14-3
Article Data31
CAS DataBase
Density 1.5 g/cm³
Solubility Slightly soluble in water. Soluble in methanol.
Melting Point 35-38 °C
Formula C₁₀H₁₈INO₂
Boiling Point 318.8 °C at 760 mmHg
Molecular Weight 311.163
Flash Point 146.6 °C
Transport Information
Appearance
Safety 22-26-36/37/39
Risk Codes 22-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms 1,1-Dimethylethyl4-iodo-1-piperidine-1-carboxylate;1-(tert-Butoxycarbonyl)-4-iodopiperidine;4-Iodo-N-tert-butoxycarbonylpiperidine;4-Iodopiperidine-1-carboxylic acid tert-butyl ester;tert-Butyl4-iodopiperidine-1-carboxylate;
PSA 29.54000
LogP 2.75880

N-Boc-4-iodopiperidine Specification

The CAS register number of N-Boc-4-iodopiperidine is 301673-14-3. It also can be called as 4-Iodopiperidine-1-carboxylic acid tert-butyl ester and the IUPAC name about this chemical is tert-butyl 4-iodopiperidine-1-carboxylate. It belongs to the following product categories, such as pharmacetical, Heterocyclic Building Blocks and so on.

Physical properties about N-Boc-4-iodopiperidine are: (1)ACD/LogP: 2.64; (2)ACD/LogD (pH 5.5): 2.64; (3)ACD/LogD (pH 7.4): 2.64; (4)ACD/BCF (pH 5.5): 59.91; (5)ACD/BCF (pH 7.4): 59.91; (6)ACD/KOC (pH 5.5): 651.57; (7)ACD/KOC (pH 7.4): 651.57; (8)#H bond acceptors: 3 ; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 29.54Å²; (11)Index of Refraction: 1.542; (12)Molar Refractivity: 64.95 cm³; (13)Molar Volume: 206.2 cm³; (14)Polarizability: 25.74x10^-24cm³; (15)Surface Tension: 41.2 dyne/cm; (16)Enthalpy of Vaporization: 56.04 kJ/mol; (17)Boiling Point: 318.8 °C at 760 mmHg; (18)Vapour Pressure: 0.000352 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N1CCC(I)CC1
(2)InChI: InChI=1/C10H18INO2/c1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h8H,4-7H2,1-3H3
(3)InChIKey: YFWQFKUQVJNPKP-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C10H18INO2/c1-10(2,3)14-9(13)12-6-4-8(11)5-7-12/h8H,4-7H2,1-3H3
(5)Std. InChIKey: YFWQFKUQVJNPKP-UHFFFAOYSA-N

Product Name

N-Boc-4-iodopiperidine

N-Boc-4-iodopiperidine Specification

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