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Home > Fluorides > 167953-74-4
167953-74-4 | Phenol, 4,4'-(9H-fluoren-9-ylidene)bis[3-methyl-
CAS No: 167953-74-4 Catalog No: AG001XPG MDL No:
Product Description
Catalog Number:
AG001XPG
Chemical Name:
Phenol, 4,4'-(9H-fluoren-9-ylidene)bis[3-methyl-
CAS Number:
167953-74-4
Molecular Formula:
C27H22O2
Molecular Weight:
378.4624
IUPAC Name:
4-[9-(4-hydroxy-2-methylphenyl)fluoren-9-yl]-3-methylphenol
InChI:
InChI=1S/C27H22O2/c1-17-15-19(28)11-13-23(17)27(24-14-12-20(29)16-18(24)2)25-9-5-3-7-21(25)22-8-4-6-10-26(22)27/h3-16,28-29H,1-2H3
InChI Key:
KBKLXLYSUOMJQE-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)C)C1(c2ccc(cc2C)O)c2ccccc2c2c1cccc2
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.162g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
378.471g/mol
Monoisotopic Mass:
378.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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