Home Halogens methyl 2-amino-3,6-dibromobenzoate

methyl 2-amino-3,6-dibromobenzoate

CAS No.:
1219795-57-9
Catalog Number:
AG01BTCG
Molecular Formula:
C8H7Br2NO2
Molecular Weight:
308.9547
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Product Description
Catalog Number:
AG01BTCG
Chemical Name:
methyl 2-amino-3,6-dibromobenzoate
CAS Number:
1219795-57-9
Molecular Formula:
C8H7Br2NO2
Molecular Weight:
308.9547
MDL Number:
MFCD14673458
IUPAC Name:
methyl 2-amino-3,6-dibromobenzoate
InChI:
InChI=1S/C8H7Br2NO2/c1-13-8(12)6-4(9)2-3-5(10)7(6)11/h2-3H,11H2,1H3
InChI Key:
GHEZQQJVBNVTEY-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(Br)ccc(c1N)Br
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.882g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.957g/mol
Monoisotopic Mass:
306.884g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties