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248270-23-7 | 1,3-Dioxolane, 2-(4-bromo-2-fluorophenyl)-
CAS No: 248270-23-7 Catalog No: AG002PKG MDL No:MFCD06209216
Product Description
Catalog Number:
AG002PKG
Chemical Name:
1,3-Dioxolane, 2-(4-bromo-2-fluorophenyl)-
CAS Number:
248270-23-7
Molecular Formula:
C9H8BrFO2
Molecular Weight:
247.0610
MDL Number:
MFCD06209216
IUPAC Name:
2-(4-bromo-2-fluorophenyl)-1,3-dioxolane
InChI:
InChI=1S/C9H8BrFO2/c10-6-1-2-7(8(11)5-6)9-12-3-4-13-9/h1-2,5,9H,3-4H2
InChI Key:
QBJYRHCYSHXBAY-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)F)C1OCCO1
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.969g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.063g/mol
Monoisotopic Mass:
245.969g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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