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Home > Fluorides > 140377-92-0
140377-92-0 | 1(2H)-Naphthalenone, 5-fluoro-3,4-dihydro-7,8-dimethoxy-
CAS No: 140377-92-0 Catalog No: AG001CBR MDL No:MFCD17237580
Product Description
Catalog Number:
AG001CBR
Chemical Name:
1(2H)-Naphthalenone, 5-fluoro-3,4-dihydro-7,8-dimethoxy-
CAS Number:
140377-92-0
Molecular Formula:
C12H13FO3
Molecular Weight:
224.2282
MDL Number:
MFCD17237580
IUPAC Name:
5-fluoro-7,8-dimethoxy-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C12H13FO3/c1-15-10-6-8(13)7-4-3-5-9(14)11(7)12(10)16-2/h6H,3-5H2,1-2H3
InChI Key:
UVWCXSFRGNXNGL-UHFFFAOYSA-N
SMILES:
COc1c(OC)cc(c2c1C(=O)CCC2)F
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.231g/mol
Monoisotopic Mass:
224.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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