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Home > Fluorides > 1395282-61-7
1395282-61-7 | Oxetane, 3-(3,5-difluorophenyl)-
CAS No: 1395282-61-7 Catalog No: AG001B6E MDL No:
Product Description
Catalog Number:
AG001B6E
Chemical Name:
Oxetane, 3-(3,5-difluorophenyl)-
CAS Number:
1395282-61-7
Molecular Formula:
C9H8F2O
Molecular Weight:
170.1560
IUPAC Name:
3-(3,5-difluorophenyl)oxetane
InChI:
InChI=1S/C9H8F2O/c10-8-1-6(2-9(11)3-8)7-4-12-5-7/h1-3,7H,4-5H2
InChI Key:
HXPFONZQUZWQRU-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)F)C1COC1
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.159g/mol
Monoisotopic Mass:
170.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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