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Home > Fluorides > 1243463-05-9
1243463-05-9 | Phenol, 4-(cyclopropylmethoxy)-3-(trifluoromethyl)-
CAS No: 1243463-05-9 Catalog No: AG000LWF MDL No:
Product Description
Catalog Number:
AG000LWF
Chemical Name:
Phenol, 4-(cyclopropylmethoxy)-3-(trifluoromethyl)-
CAS Number:
1243463-05-9
Molecular Formula:
C11H11F3O2
Molecular Weight:
232.1990
IUPAC Name:
4-(cyclopropylmethoxy)-3-(trifluoromethyl)phenol
InChI:
InChI=1S/C11H11F3O2/c12-11(13,14)9-5-8(15)3-4-10(9)16-6-7-1-2-7/h3-5,7,15H,1-2,6H2
InChI Key:
INXVKMUDJGDWEL-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)C(F)(F)F)OCC1CC1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.071g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.202g/mol
Monoisotopic Mass:
232.071g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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