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Home > Fluorides > 1443341-12-5
1443341-12-5 | 3-[2-(1,3-Dioxanyl)]-1-(2-fluorophenyl)-1-propanol
CAS No: 1443341-12-5 Catalog No: AG01F931 MDL No:
Product Description
Catalog Number:
AG01F931
Chemical Name:
3-[2-(1,3-Dioxanyl)]-1-(2-fluorophenyl)-1-propanol
CAS Number:
1443341-12-5
Molecular Formula:
C13H17FO3
Molecular Weight:
240.2707
IUPAC Name:
3-(1,3-dioxan-2-yl)-1-(2-fluorophenyl)propan-1-ol
InChI:
InChI=1S/C13H17FO3/c14-11-5-2-1-4-10(11)12(15)6-7-13-16-8-3-9-17-13/h1-2,4-5,12-13,15H,3,6-9H2
InChI Key:
ZQRWBRJLYSRINV-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1F)CCC1OCCCO1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.274g/mol
Monoisotopic Mass:
240.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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