6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol

C20H20O2 — CID 143003340

IUPAC6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol
SMILESC=C1C(C)=C(c2ccc(O)c(C)c2)Cc2cc(C)cc(O)c21
InChIInChI=1S/C20H20O2/c1-11-7-16-10-17(15-5-6-18(21)12(2)9-15)13(3)14(4)20(16)19(22)8-11/h5-9,21-22H,4,10H2,1-3H3
InChIKeyASTWHRHJJBPZCT-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.76
Rot. Bonds1

About 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol

6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol (PubChem CID 143003340) has the molecular formula C20H20O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol.

Molecular Properties

Compound Name6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol
PubChem CID143003340
Molecular FormulaC20H20O2
Molecular Weight292.38 g/mol
Exact Mass292.15
IUPAC Name6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol
SMILESC=C1C(C)=C(c2ccc(O)c(C)c2)Cc2cc(C)cc(O)c21
InChIInChI=1S/C20H20O2/c1-11-7-16-10-17(15-5-6-18(21)12(2)9-15)13(3)14(4)20(16)19(22)8-11/h5-9,21-22H,4,10H2,1-3H3
InChIKeyASTWHRHJJBPZCT-UHFFFAOYSA-N
XLogP4.76
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-bis(4-hydroxy-3-methylphenyl)-4-methylphenol
CID 150395203
4-(3-chloro-5-methylphenyl)-2-methylphenol
CID 53218974
ethene;2-(4-hydroxy-3-methylphenyl)-4-methylphenol
CID 143337895
4-(2,3-dihydro-1H-inden-5-yl)-2-methylphenol
CID 166178430
9-hydroxy-7-methyl-1,2,3,5-tetrahydrocyclopenta[a]naphthalen-4-one
CID 159988514
2-methyl-4-(4-phenylphenyl)phenol
CID 83131251
4-(2,6-diethylphenyl)-2-methylphenol
CID 154385947
4-(2,4-dimethylphenyl)-2-methylphenol
CID 53218818
2,4-dimethylphenol
CID 67713801
4-[6-(4-hydroxy-3-methylphenyl)-1,2-dihydroacenaphthylen-5-yl]-2-methylphenol
CID 11793283
2-methyl-4-(3-methylthiophen-2-yl)phenol
CID 53445621
2,4-dimethylphenol;yttrium
CID 87733318

Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol?
The IUPAC name of 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol (CID 143003340) is 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol.
What is the SMILES notation for 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol?
The canonical SMILES for 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol is C=C1C(C)=C(c2ccc(O)c(C)c2)Cc2cc(C)cc(O)c21.
What is the InChIKey of 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol?
The InChIKey is ASTWHRHJJBPZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20O2/c1-11-7-16-10-17(15-5-6-18(21)12(2)9-15)13(3)14(4)20(16)19(22)8-11/h5-9,21-22H,4,10H2,1-3H3.
What are the key properties of 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol?
6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol has a molecular weight of 292.38 g/mol, XLogP of 4.76, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxy-3-methylphenyl)-3,7-dimethyl-8-methylidene-5H-naphthalen-1-ol is sourced from PubChem (CID 143003340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).