4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol

C24H34O2 — CID 18691662

IUPAC4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol
SMILESCCC1(C)C=C(C)C2=C(C1)C(C)(C)CC(C)(c1cc(C)c(O)c(C)c1)O2
InChIInChI=1S/C24H34O2/c1-9-23(7)12-17(4)21-19(13-23)22(5,6)14-24(8,26-21)18-10-15(2)20(25)16(3)11-18/h10-12,25H,9,13-14H2,1-8H3
InChIKeyYOEIHNWRNMDIDX-UHFFFAOYSA-N
MW354.53 g/mol
LogP6.69
Rot. Bonds2

About 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol

4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol (PubChem CID 18691662) has the molecular formula C24H34O2 and a molecular weight of 354.53 g/mol. Its IUPAC name is 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol.

Molecular Properties

Compound Name4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol
PubChem CID18691662
Molecular FormulaC24H34O2
Molecular Weight354.53 g/mol
Exact Mass354.26
IUPAC Name4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol
SMILESCCC1(C)C=C(C)C2=C(C1)C(C)(C)CC(C)(c1cc(C)c(O)c(C)c1)O2
InChIInChI=1S/C24H34O2/c1-9-23(7)12-17(4)21-19(13-23)22(5,6)14-24(8,26-21)18-10-15(2)20(25)16(3)11-18/h10-12,25H,9,13-14H2,1-8H3
InChIKeyYOEIHNWRNMDIDX-UHFFFAOYSA-N
XLogP6.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.53
LogP ≤ 56.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol?
The IUPAC name of 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol (CID 18691662) is 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol.
What is the SMILES notation for 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol?
The canonical SMILES for 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol is CCC1(C)C=C(C)C2=C(C1)C(C)(C)CC(C)(c1cc(C)c(O)c(C)c1)O2.
What is the InChIKey of 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol?
The InChIKey is YOEIHNWRNMDIDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34O2/c1-9-23(7)12-17(4)21-19(13-23)22(5,6)14-24(8,26-21)18-10-15(2)20(25)16(3)11-18/h10-12,25H,9,13-14H2,1-8H3.
What are the key properties of 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol?
4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol has a molecular weight of 354.53 g/mol, XLogP of 6.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-ethyl-2,4,4,6,8-pentamethyl-3,5-dihydrochromen-2-yl)-2,6-dimethylphenol is sourced from PubChem (CID 18691662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).