2-Bromo-5-(tert-butoxycarbonylamino)pyridine supplier

Name
2-BROMO-5-(TERT-BUTOXYCARBONYLAMINO)PYRIDINE
EINECS
CAS No. 218594-15-1
Article Data7
CAS DataBase
Density 1.454 g/cm³
Solubility
Melting Point 124-126°C
Formula C₁₀H₁₃BrN₂O₂
Boiling Point 300.96 °C at 760 mmHg
Molecular Weight 273.129
Flash Point 135.816 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Bromo-5-boc-aminopyridine;tert-Butyl(6-bromopyridin-3-yl)carbamate;
PSA 51.22000
LogP 3.26410

2-Bromo-5-(tert-butoxycarbonylamino)pyridine Specification

The Carbamic acid,(6-bromo-3-pyridinyl)-, 1,1-dimethylethyl ester (9CI), with CAS registry number 218594-15-1, belongs to the following product categories: (1)Amines; (2)Blocks; (3)Bromides; (4)Pyridines. It has the systematic name of tert-butyl (6-bromopyridin-3-yl)carbamate. And the chemical formula of this chemical is C₁₀H₁₃BrN₂O₂.

Physical properties of Carbamic acid,(6-bromo-3-pyridinyl)-, 1,1-dimethylethyl ester (9CI): (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 42.43 Å²; (7)Index of Refraction: 1.573; (8)Molar Refractivity: 61.91 cm³; (9)Molar Volume: 187.8 cm³; (10)Polarizability: 24.54×10^-24cm³; (11)Surface Tension: 46.2 dyne/cm; (12)Density: 1.453 g/cm³; (13)Flash Point: 135.8 °C; (14)Enthalpy of Vaporization: 54.11 kJ/mol; (15)Boiling Point: 301 °C at 760 mmHg; (16)Vapour Pressure: 0.00109 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ncc(NC(=O)OC(C)(C)C)cc1
(2)InChI: InChI=1/C10H13BrN2O2/c1-10(2,3)15-9(14)13-7-4-5-8(11)12-6-7/h4-6H,1-3H3,(H,13,14)
(3)InChIKey: LSFAQGJWQMNXLP-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C10H13BrN2O2/c1-10(2,3)15-9(14)13-7-4-5-8(11)12-6-7/h4-6H,1-3H3,(H,13,14)
(5)Std. InChIKey: LSFAQGJWQMNXLP-UHFFFAOYSA-N

Product Name

2-BROMO-5-(TERT-BUTOXYCARBONYLAMINO)PYRIDINE

2-Bromo-5-(tert-butoxycarbonylamino)pyridine Specification

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