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Home > Fluorides > 137114-68-2
137114-68-2 | 1(2H)-Naphthalenone, 6,7-difluoro-3,4-dihydro-
CAS No: 137114-68-2 Catalog No: AG0012V0 MDL No:MFCD08234366
Product Description
Catalog Number:
AG0012V0
Chemical Name:
1(2H)-Naphthalenone, 6,7-difluoro-3,4-dihydro-
CAS Number:
137114-68-2
Molecular Formula:
C10H8F2O
Molecular Weight:
182.1667
MDL Number:
MFCD08234366
IUPAC Name:
6,7-difluoro-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C10H8F2O/c11-8-4-6-2-1-3-10(13)7(6)5-9(8)12/h4-5H,1-3H2
InChI Key:
TYXBYMJRIQHKHT-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1cc(F)c(c2)F
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.17g/mol
Monoisotopic Mass:
182.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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