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Home > Fluorides > 219998-30-8
219998-30-8 | 1,3,5-Trifluoro-2-methoxybenzene
CAS No: 219998-30-8 Catalog No: AG003O0O MDL No:MFCD01631502
Product Description
Catalog Number:
AG003O0O
Chemical Name:
1,3,5-Trifluoro-2-methoxybenzene
CAS Number:
219998-30-8
Molecular Formula:
C7H5F3O
Molecular Weight:
162.1092
MDL Number:
MFCD01631502
IUPAC Name:
1,3,5-trifluoro-2-methoxybenzene
InChI:
InChI=1S/C7H5F3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3
InChI Key:
ZLRIBYUOFAKHEF-UHFFFAOYSA-N
SMILES:
COc1c(F)cc(cc1F)F
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.029g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.111g/mol
Monoisotopic Mass:
162.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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