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1208078-12-9 | Ethyl 3-Bromo-4-iodophenylacetate
CAS No: 1208078-12-9 Catalog No: AG01FEBO MDL No:MFCD12547820
Product Description
Catalog Number:
AG01FEBO
Chemical Name:
Ethyl 3-Bromo-4-iodophenylacetate
CAS Number:
1208078-12-9
Molecular Formula:
C10H10BrIO2
Molecular Weight:
368.9937
MDL Number:
MFCD12547820
IUPAC Name:
ethyl 2-(3-bromo-4-iodophenyl)acetate
InChI:
InChI=1S/C10H10BrIO2/c1-2-14-10(13)6-7-3-4-9(12)8(11)5-7/h3-5H,2,6H2,1H3
InChI Key:
ZGXZMDLTWIQYGC-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1ccc(c(c1)Br)I
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.891g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.996g/mol
Monoisotopic Mass:
367.891g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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