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175355-98-3 | Phenol, 4-methyl-2-(1,2,2-trimethylcyclopentyl)-
CAS No: 175355-98-3 Catalog No: AG0020XS MDL No:
Product Description
Catalog Number:
AG0020XS
Chemical Name:
Phenol, 4-methyl-2-(1,2,2-trimethylcyclopentyl)-
CAS Number:
175355-98-3
Molecular Formula:
C15H22O
Molecular Weight:
218.3346
IUPAC Name:
4-methyl-2-(1,2,2-trimethylcyclopentyl)phenol
InChI:
InChI=1S/C15H22O/c1-11-6-7-13(16)12(10-11)15(4)9-5-8-14(15,2)3/h6-7,10,16H,5,8-9H2,1-4H3
InChI Key:
OJURUWLXPJSRPZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C1(C)CCCC1(C)C)O
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.167g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.34g/mol
Monoisotopic Mass:
218.167g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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