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34633-00-6 | 4,5-dimethyl-2-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)phenol
CAS No: 34633-00-6 Catalog No: AG007D6A MDL No:
Product Description
Catalog Number:
AG007D6A
Chemical Name:
4,5-dimethyl-2-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)phenol
CAS Number:
34633-00-6
Molecular Formula:
C18H26O
Molecular Weight:
258.3984
IUPAC Name:
4,5-dimethyl-2-(5,5,6-trimethyl-2-bicyclo[2.2.1]heptanyl)phenol
InChI:
InChI=1S/C18H26O/c1-10-6-16(17(19)7-11(10)2)15-9-13-8-14(15)12(3)18(13,4)5/h6-7,12-15,19H,8-9H2,1-5H3
InChI Key:
QVKROXHNVAKLSP-UHFFFAOYSA-N
SMILES:
CC1C2CC(C1(C)C)CC2c1cc(C)c(cc1O)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.198g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.405g/mol
Monoisotopic Mass:
258.198g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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