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Home Carbonyls 5-Bromo-2-(methoxycarbonylamino)pyridine

5-Bromo-2-(methoxycarbonylamino)pyridine

CAS No.:
207922-56-3
Catalog Number:
AG002JDG
Molecular Formula:
C7H7BrN2O2
Molecular Weight:
231.0467
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$188
- +
5g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG002JDG
Chemical Name:
5-Bromo-2-(methoxycarbonylamino)pyridine
CAS Number:
207922-56-3
Molecular Formula:
C7H7BrN2O2
Molecular Weight:
231.0467
MDL Number:
MFCD00739213
IUPAC Name:
methyl N-(5-bromopyridin-2-yl)carbamate
InChI:
InChI=1S/C7H7BrN2O2/c1-12-7(11)10-6-3-2-5(8)4-9-6/h2-4H,1H3,(H,9,10,11)
InChI Key:
XYBRWUNZRUBCGY-UHFFFAOYSA-N
SMILES:
COC(=O)Nc1ccc(cn1)Br
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.969g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.049g/mol
Monoisotopic Mass:
229.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties