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141967-82-0 | Phenol, 4-[3-(trifluoromethyl)nonyl]-
CAS No: 141967-82-0 Catalog No: AG001HGF MDL No:
Product Description
Catalog Number:
AG001HGF
Chemical Name:
Phenol, 4-[3-(trifluoromethyl)nonyl]-
CAS Number:
141967-82-0
Molecular Formula:
C16H23F3O
Molecular Weight:
288.3484
IUPAC Name:
4-[3-(trifluoromethyl)nonyl]phenol
InChI:
InChI=1S/C16H23F3O/c1-2-3-4-5-6-14(16(17,18)19)10-7-13-8-11-15(20)12-9-13/h8-9,11-12,14,20H,2-7,10H2,1H3
InChI Key:
SYDPNWKAIGZFKQ-UHFFFAOYSA-N
SMILES:
CCCCCCC(C(F)(F)F)CCc1ccc(cc1)O
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.17g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.354g/mol
Monoisotopic Mass:
288.17g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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