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Home > Bromides > 1160574-83-3
1160574-83-3 | Ethyl 5-Chloro-3,4-dibromobenzoate
CAS No: 1160574-83-3 Catalog No: AG01FE21 MDL No:MFCD11846095
Product Description
Catalog Number:
AG01FE21
Chemical Name:
Ethyl 5-Chloro-3,4-dibromobenzoate
CAS Number:
1160574-83-3
Molecular Formula:
C9H7Br2ClO2
Molecular Weight:
342.4117
MDL Number:
MFCD11846095
IUPAC Name:
ethyl 3,4-dibromo-5-chlorobenzoate
InChI:
InChI=1S/C9H7Br2ClO2/c1-2-14-9(13)5-3-6(10)8(11)7(12)4-5/h3-4H,2H2,1H3
InChI Key:
NDQVOMSACBVPJP-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Cl)c(c(c1)Br)Br
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.848g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.411g/mol
Monoisotopic Mass:
339.85g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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