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3308-94-9 | 2-(3-chloropropyl)-2-(4-fluorophenyl)-1,3-dioxolane
CAS No: 3308-94-9 Catalog No: AG003ETQ MDL No:MFCD00020909
Product Description
Catalog Number:
AG003ETQ
Chemical Name:
2-(3-chloropropyl)-2-(4-fluorophenyl)-1,3-dioxolane
CAS Number:
3308-94-9
Molecular Formula:
C12H14ClFO2
Molecular Weight:
244.6898
MDL Number:
MFCD00020909
IUPAC Name:
2-(3-chloropropyl)-2-(4-fluorophenyl)-1,3-dioxolane
InChI:
InChI=1S/C12H14ClFO2/c13-7-1-6-12(15-8-9-16-12)10-2-4-11(14)5-3-10/h2-5H,1,6-9H2
InChI Key:
FXFDJSQOCVDXBX-UHFFFAOYSA-N
SMILES:
ClCCCC1(OCCO1)c1ccc(cc1)F
EC Number:
221-993-9
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.067g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.69g/mol
Monoisotopic Mass:
244.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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