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Home > Bromides > 1261751-13-6
1261751-13-6 | Ethyl 2-bromo-3-chlorobenzoate
CAS No: 1261751-13-6 Catalog No: AG01FF0N MDL No:MFCD18395857
Product Description
Catalog Number:
AG01FF0N
Chemical Name:
Ethyl 2-bromo-3-chlorobenzoate
CAS Number:
1261751-13-6
Molecular Formula:
C9H8BrClO2
Molecular Weight:
263.5156
MDL Number:
MFCD18395857
IUPAC Name:
ethyl 2-bromo-3-chlorobenzoate
InChI:
InChI=1S/C9H8BrClO2/c1-2-13-9(12)6-4-3-5-7(11)8(6)10/h3-5H,2H2,1H3
InChI Key:
TYIFFCZRIWXIBT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1Br)Cl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.94g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.515g/mol
Monoisotopic Mass:
261.94g/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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