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395-23-3 | Phenyl(4-(trifluoromethyl)phenyl)methanol
CAS No: 395-23-3 Catalog No: AG003KBL MDL No:MFCD00014399
Product Description
Catalog Number:
AG003KBL
Chemical Name:
Phenyl(4-(trifluoromethyl)phenyl)methanol
CAS Number:
395-23-3
Molecular Formula:
C14H11F3O
Molecular Weight:
252.2317
MDL Number:
MFCD00014399
IUPAC Name:
phenyl-[4-(trifluoromethyl)phenyl]methanol
InChI:
InChI=1S/C14H11F3O/c15-14(16,17)12-8-6-11(7-9-12)13(18)10-4-2-1-3-5-10/h1-9,13,18H
InChI Key:
LIZDGCXCDJOWBS-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)c1ccc(cc1)C(F)(F)F
NSC Number:
88345
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.076g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.236g/mol
Monoisotopic Mass:
252.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Identification and characterization of novel sirtuin inhibitor scaffolds. | Bioorganic & medicinal chemistry 20091001 |
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