Home Halogens 4-(3-chloropropyl)-4-(4-fluorophenyl)-1,3-dioxolane

4-(3-chloropropyl)-4-(4-fluorophenyl)-1,3-dioxolane

CAS No.:
3406-77-7
Catalog Number:
AG007HL1
Molecular Formula:
C12H14ClFO2
Molecular Weight:
244.6898
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Product Description
Catalog Number:
AG007HL1
Chemical Name:
4-(3-chloropropyl)-4-(4-fluorophenyl)-1,3-dioxolane
CAS Number:
3406-77-7
Molecular Formula:
C12H14ClFO2
Molecular Weight:
244.6898
MDL Number:
MFCD00570562
IUPAC Name:
2-(4-methoxyphenyl)sulfanylacetic acid
InChI:
InChI=1S/C9H10O3S/c1-12-7-2-4-8(5-3-7)13-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key:
WPRFIGTZKOUYRL-UHFFFAOYSA-N
SMILES:
ClCCCC1(OCOC1)c1ccc(cc1)F
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.035g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.236g/mol
Monoisotopic Mass:
198.035g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties