CAS No.154048-89-2,(4-IODO-PYRIDIN-3-YL)-CARBAMIC ACID TERT-BUTYL ESTER Suppliers

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Basic Information

Molecular Structure:
CAS No.:	154048-89-2
Name:	(4-IODO-PYRIDIN-3-YL)-CARBAMIC ACID TERT-BUTYL ESTER
Article Data:	9

Formula:	C₁₀H₁₃IN₂O₂
Molecular Weight:	320.13
Synonyms:	(4-Iodo-3-pyridinyl)-carbamic acid, 1,1-dimethylethyl ester;tert-Butyl (4-iodopyridin-3-yl)carbamate;
Density:	1.652 g/cm³
Melting Point:	72-76℃
Boiling Point:	313.221 °C at 760 mmHg
Flash Point:	143.231 °C
PSA:	51.22000
LogP:	3.10620

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Specification

The Carbamic acid,N-(4-iodo-3-pyridinyl)-, 1,1-dimethylethyl ester is an organic compound with the formula C₁₀H₁₃IN₂O₂. The IUPAC name of this chemical is Tert-butyl N-(4-iodopyridin-3-yl)carbamate. With the CAS registry number 154048-89-2, it is also named as (4-Iodo-3-pyridinyl)-carbamic acid, 1,1-dimethylethyl ester. Besides, its molecular weight is 320.13.

Physical properties about Carbamic acid,N-(4-iodo-3-pyridinyl)-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 2.75; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 26; (5)ACD/BCF (pH 7.4): 27; (6)ACD/KOC (pH 5.5): 357; (7)ACD/KOC (pH 7.4): 364; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 51.22 Å²; (12)Index of Refraction: 1.61; (13)Molar Refractivity: 67.132 cm³; (14)Molar Volume: 193.744 cm³; (15)Polarizability: 26.613×10^-24 cm³; (16)Surface Tension: 49.881 dyne/cm; (17)Density: 1.652 g/cm³; (18)Flash Point: 143.231 °C; (19)Enthalpy of Vaporization: 55.428 kJ/mol; (20)Boiling Point: 313.221 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H13IN2O2/c1-10(2,3)15-9(14)13-8-6-12-5-4-7(8)11/h4-6H,1-3H3,(H,13,14)
(2)InChIKey: FUKNUVWILSPUSJ-UHFFFAOYAB
(3)Std. InChI: InChI=1S/C10H13IN2O2/c1-10(2,3)15-9(14)13-8-6-12-5-4-7(8)11/h4-6H,1-3H3,(H,13,14)
(4)Std. InChIKey: FUKNUVWILSPUSJ-UHFFFAOYSA-N