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156749-76-7 | Phenol, 4,4'-cyclopentylidenebis[2,6-dimethyl-
CAS No: 156749-76-7 Catalog No: AG001OYI MDL No:
Product Description
Catalog Number:
AG001OYI
Chemical Name:
Phenol, 4,4'-cyclopentylidenebis[2,6-dimethyl-
CAS Number:
156749-76-7
Molecular Formula:
C21H26O2
Molecular Weight:
310.4299
IUPAC Name:
4-[1-(4-hydroxy-3,5-dimethylphenyl)cyclopentyl]-2,6-dimethylphenol
InChI:
InChI=1S/C21H26O2/c1-13-9-17(10-14(2)19(13)22)21(7-5-6-8-21)18-11-15(3)20(23)16(4)12-18/h9-12,22-23H,5-8H2,1-4H3
InChI Key:
NHPARHIYVDSSNU-UHFFFAOYSA-N
SMILES:
Cc1cc(cc(c1O)C)C1(CCCC1)c1cc(C)c(c(c1)C)O
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.193g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
310.437g/mol
Monoisotopic Mass:
310.193g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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