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1638-63-7 | Benzeneacetyl chloride, α-(acetyloxy)-
CAS No: 1638-63-7 Catalog No: AG001UE7 MDL No:
Product Description
Catalog Number:
AG001UE7
Chemical Name:
Benzeneacetyl chloride, α-(acetyloxy)-
CAS Number:
1638-63-7
Molecular Formula:
C10H9ClO3
Molecular Weight:
212.6297
IUPAC Name:
(2-chloro-2-oxo-1-phenylethyl) acetate
InChI:
InChI=1S/C10H9ClO3/c1-7(12)14-9(10(11)13)8-5-3-2-4-6-8/h2-6,9H,1H3
InChI Key:
BERNQQVIUAZUHY-UHFFFAOYSA-N
SMILES:
ClC(=O)C(c1ccccc1)OC(=O)C
EC Number:
216-674-6
NSC Number:
28337
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.024g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.629g/mol
Monoisotopic Mass:
212.024g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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