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122606-55-7 | 1,3-Dioxolan-2-one, 4-(4-chlorophenyl)-
CAS No: 122606-55-7 Catalog No: AG0017JU MDL No:
Product Description
Catalog Number:
AG0017JU
Chemical Name:
1,3-Dioxolan-2-one, 4-(4-chlorophenyl)-
CAS Number:
122606-55-7
Molecular Formula:
C9H7ClO3
Molecular Weight:
198.6031
IUPAC Name:
4-(4-chlorophenyl)-1,3-dioxolan-2-one
InChI:
InChI=1S/C9H7ClO3/c10-7-3-1-6(2-4-7)8-5-12-9(11)13-8/h1-4,8H,5H2
InChI Key:
ZPRQKRGNDGAETC-UHFFFAOYSA-N
SMILES:
O=C1OCC(O1)c1ccc(cc1)Cl
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.008g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.602g/mol
Monoisotopic Mass:
198.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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