Home Halogens Methyl 2,3-diamino-5-bromobenzoate

Methyl 2,3-diamino-5-bromobenzoate

CAS No.:
1248541-63-0
Catalog Number:
AG000MST
Molecular Formula:
C8H9BrN2O2
Molecular Weight:
245.0733
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$228
- +
5g
98%
In Stock USA
United States
$732
- +
Product Description
Catalog Number:
AG000MST
Chemical Name:
Methyl 2,3-diamino-5-bromobenzoate
CAS Number:
1248541-63-0
Molecular Formula:
C8H9BrN2O2
Molecular Weight:
245.0733
MDL Number:
MFCD20037660
IUPAC Name:
methyl 2,3-diamino-5-bromobenzoate
InChI:
InChI=1S/C8H9BrN2O2/c1-13-8(12)5-2-4(9)3-6(10)7(5)11/h2-3H,10-11H2,1H3
InChI Key:
GBHLKSOAANWXOZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)cc(c1N)N
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.985g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.076g/mol
Monoisotopic Mass:
243.985g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties