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Home > Fluorides > 189019-72-5
189019-72-5 | 1,3-Dioxolane, 4-(4-ethoxybutyl)-2,2-dimethyl-5-(trifluoromethyl)-
CAS No: 189019-72-5 Catalog No: AG002HQ0 MDL No:
Product Description
Catalog Number:
AG002HQ0
Chemical Name:
1,3-Dioxolane, 4-(4-ethoxybutyl)-2,2-dimethyl-5-(trifluoromethyl)-
CAS Number:
189019-72-5
Molecular Formula:
C12H21F3O3
Molecular Weight:
270.2885
IUPAC Name:
4-(4-ethoxybutyl)-2,2-dimethyl-5-(trifluoromethyl)-1,3-dioxolane
InChI:
InChI=1S/C12H21F3O3/c1-4-16-8-6-5-7-9-10(12(13,14)15)18-11(2,3)17-9/h9-10H,4-8H2,1-3H3
InChI Key:
MHKZCVSYUXTPLV-UHFFFAOYSA-N
SMILES:
CCOCCCCC1OC(OC1C(F)(F)F)(C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.144g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.292g/mol
Monoisotopic Mass:
270.144g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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