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Home > Fluorides > 138490-98-9
138490-98-9 | Benzenemethanol, 3,4-dimethoxy-2-(trifluoromethyl)-
CAS No: 138490-98-9 Catalog No: AG00199U MDL No:MFCD14705136
Product Description
Catalog Number:
AG00199U
Chemical Name:
Benzenemethanol, 3,4-dimethoxy-2-(trifluoromethyl)-
CAS Number:
138490-98-9
Molecular Formula:
C10H11F3O3
Molecular Weight:
236.1877
MDL Number:
MFCD14705136
IUPAC Name:
[3,4-dimethoxy-2-(trifluoromethyl)phenyl]methanol
InChI:
InChI=1S/C10H11F3O3/c1-15-7-4-3-6(5-14)8(9(7)16-2)10(11,12)13/h3-4,14H,5H2,1-2H3
InChI Key:
QQEVWZMTFIRWPZ-UHFFFAOYSA-N
SMILES:
OCc1ccc(c(c1C(F)(F)F)OC)OC
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.066g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.19g/mol
Monoisotopic Mass:
236.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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