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Home > Fluorides > 122770-39-2
122770-39-2 | 1,4-Dioxaspiro[4.5]decan-8-ol, 8-(4-fluorophenyl)-
CAS No: 122770-39-2 Catalog No: AG000JGE MDL No:MFCD21078734
Product Description
Catalog Number:
AG000JGE
Chemical Name:
1,4-Dioxaspiro[4.5]decan-8-ol, 8-(4-fluorophenyl)-
CAS Number:
122770-39-2
Molecular Formula:
C14H17FO3
Molecular Weight:
252.2814
MDL Number:
MFCD21078734
IUPAC Name:
8-(4-fluorophenyl)-1,4-dioxaspiro[4.5]decan-8-ol
InChI:
InChI=1S/C14H17FO3/c15-12-3-1-11(2-4-12)13(16)5-7-14(8-6-13)17-9-10-18-14/h1-4,16H,5-10H2
InChI Key:
BBKOAONWYJVESW-UHFFFAOYSA-N
SMILES:
OC1(CCC2(CC1)OCCO2)c1ccc(cc1)F
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.285g/mol
Monoisotopic Mass:
252.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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