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Home > Fluorides > 158641-47-5
158641-47-5 | Benzene, 1-ethyl-2-fluoro-3,4-dimethoxy-
CAS No: 158641-47-5 Catalog No: AG001QQ4 MDL No:
Product Description
Catalog Number:
AG001QQ4
Chemical Name:
Benzene, 1-ethyl-2-fluoro-3,4-dimethoxy-
CAS Number:
158641-47-5
Molecular Formula:
C10H13FO2
Molecular Weight:
184.2074
IUPAC Name:
1-ethyl-2-fluoro-3,4-dimethoxybenzene
InChI:
InChI=1S/C10H13FO2/c1-4-7-5-6-8(12-2)10(13-3)9(7)11/h5-6H,4H2,1-3H3
InChI Key:
RYVYWYSYNWMCCU-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc(c1F)CC
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.09g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.21g/mol
Monoisotopic Mass:
184.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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