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100814-99-1 | Dioxirane, chlorophenyl-
CAS No: 100814-99-1 Catalog No: AG0002YR MDL No:
Product Description
Catalog Number:
AG0002YR
Chemical Name:
Dioxirane, chlorophenyl-
CAS Number:
100814-99-1
Molecular Formula:
C7H5ClO2
Molecular Weight:
156.5664
IUPAC Name:
3-chloro-3-phenyldioxirane
InChI:
InChI=1S/C7H5ClO2/c8-7(9-10-7)6-4-2-1-3-5-6/h1-5H
InChI Key:
QDHAIOLHCVCBOL-UHFFFAOYSA-N
SMILES:
ClC1(OO1)c1ccccc1
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.998g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.565g/mol
Monoisotopic Mass:
155.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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