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129228-76-8 | Benzoyl chloride, 2-(2-chloro-2-oxoethoxy)-
CAS No: 129228-76-8 Catalog No: AG000YZI MDL No:
Product Description
Catalog Number:
AG000YZI
Chemical Name:
Benzoyl chloride, 2-(2-chloro-2-oxoethoxy)-
CAS Number:
129228-76-8
Molecular Formula:
C9H6Cl2O3
Molecular Weight:
233.0481
IUPAC Name:
2-(2-chloro-2-oxoethoxy)benzoyl chloride
InChI:
InChI=1S/C9H6Cl2O3/c10-8(12)5-14-7-4-2-1-3-6(7)9(11)13/h1-4H,5H2
InChI Key:
XHZGIQCTPMVGKN-UHFFFAOYSA-N
SMILES:
ClC(=O)COc1ccccc1C(=O)Cl
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.969g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.044g/mol
Monoisotopic Mass:
231.969g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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