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138568-27-1 | Phenol, 4-[5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-
CAS No: 138568-27-1 Catalog No: AG0018R2 MDL No:
Product Description
Catalog Number:
AG0018R2
Chemical Name:
Phenol, 4-[5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-
CAS Number:
138568-27-1
Molecular Formula:
C18H24O
Molecular Weight:
256.3826
IUPAC Name:
4-(5-ethenyl-5-methyl-2-prop-1-en-2-ylcyclohexyl)phenol
InChI:
InChI=1S/C18H24O/c1-5-18(4)11-10-16(13(2)3)17(12-18)14-6-8-15(19)9-7-14/h5-9,16-17,19H,1-2,10-12H2,3-4H3
InChI Key:
DUTYKARAVUNUBK-UHFFFAOYSA-N
SMILES:
C=CC1(C)CCC(C(C1)c1ccc(cc1)O)C(=C)C
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.183g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.389g/mol
Monoisotopic Mass:
256.183g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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