Home Halogens methyl 3-amino-2-bromoisonicotinate

methyl 3-amino-2-bromoisonicotinate

CAS No.:
1379335-16-6
Catalog Number:
AG00A1IE
Molecular Formula:
C7H5BrN2O2--
Molecular Weight:
229.0308
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Product Description
Catalog Number:
AG00A1IE
Chemical Name:
methyl 3-amino-2-bromoisonicotinate
CAS Number:
1379335-16-6
Molecular Formula:
C7H5BrN2O2--
Molecular Weight:
229.0308
MDL Number:
MFCD17214979
IUPAC Name:
methyl 3-amino-2-bromopyridine-4-carboxylate
InChI:
InChI=1S/C7H7BrN2O2/c1-12-7(11)4-2-3-10-6(8)5(4)9/h2-3H,9H2,1H3
InChI Key:
LFIVXETXQXFVHS-UHFFFAOYSA-N
SMILES:
[c-]1[c-]nc(c(c1C(=O)OC)N)Br
Properties
Complexity:
177  
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:
4  
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:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties