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Home > Bromides > 1208075-44-8
1208075-44-8 | Ethyl 2-bromo-5-iodobenzoate
CAS No: 1208075-44-8 Catalog No: AG003Q3L MDL No:MFCD11520421
Product Description
Catalog Number:
AG003Q3L
Chemical Name:
Ethyl 2-bromo-5-iodobenzoate
CAS Number:
1208075-44-8
Molecular Formula:
C9H8BrIO2
Molecular Weight:
354.9671
MDL Number:
MFCD11520421
IUPAC Name:
ethyl 2-bromo-5-iodobenzoate
InChI:
InChI=1S/C9H8BrIO2/c1-2-13-9(12)7-5-6(11)3-4-8(7)10/h3-5H,2H2,1H3
InChI Key:
AESBDCQWLOZBNY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(I)ccc1Br
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.875g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.969g/mol
Monoisotopic Mass:
353.875g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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