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1208077-33-1 | Ethyl 3-Amino-2,6-dibromo-4-chlorobenzoate
CAS No: 1208077-33-1 Catalog No: AG01FB66 MDL No:MFCD12547839
Product Description
Catalog Number:
AG01FB66
Chemical Name:
Ethyl 3-Amino-2,6-dibromo-4-chlorobenzoate
CAS Number:
1208077-33-1
Molecular Formula:
C9H8Br2ClNO2
Molecular Weight:
357.4263
MDL Number:
MFCD12547839
IUPAC Name:
ethyl 3-amino-2,6-dibromo-4-chlorobenzoate
InChI:
InChI=1S/C9H8Br2ClNO2/c1-2-15-9(14)6-4(10)3-5(12)8(13)7(6)11/h3H,2,13H2,1H3
InChI Key:
JFEQPCSKZHUCQA-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(Br)cc(c(c1Br)N)Cl
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.859g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
357.426g/mol
Monoisotopic Mass:
354.861g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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