[4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol

C33H34O — CID 18768147

IUPAC[4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol
SMILESCC1(C)CCC(C)(C)c2cc(-c3cc(-c4ccc(CO)cc4)ccc3-c3ccccc3)ccc21
InChIInChI=1S/C33H34O/c1-32(2)18-19-33(3,4)31-21-27(15-17-30(31)32)29-20-26(24-12-10-23(22-34)11-13-24)14-16-28(29)25-8-6-5-7-9-25/h5-17,20-21,34H,18-19,22H2,1-4H3
InChIKeyWWEPHVNPNHMFKQ-UHFFFAOYSA-N
MW446.63 g/mol
LogP8.53
Rot. Bonds4

About [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol

[4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol (PubChem CID 18768147) has the molecular formula C33H34O and a molecular weight of 446.63 g/mol. Its IUPAC name is [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol
PubChem CID18768147
Molecular FormulaC33H34O
Molecular Weight446.63 g/mol
Exact Mass446.26
IUPAC Name[4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol
SMILESCC1(C)CCC(C)(C)c2cc(-c3cc(-c4ccc(CO)cc4)ccc3-c3ccccc3)ccc21
InChIInChI=1S/C33H34O/c1-32(2)18-19-33(3,4)31-21-27(15-17-30(31)32)29-20-26(24-12-10-23(22-34)11-13-24)14-16-28(29)25-8-6-5-7-9-25/h5-17,20-21,34H,18-19,22H2,1-4H3
InChIKeyWWEPHVNPNHMFKQ-UHFFFAOYSA-N
XLogP8.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.63
LogP ≤ 58.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol?
The IUPAC name of [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol (CID 18768147) is [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol.
What is the SMILES notation for [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol?
The canonical SMILES for [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol is CC1(C)CCC(C)(C)c2cc(-c3cc(-c4ccc(CO)cc4)ccc3-c3ccccc3)ccc21.
What is the InChIKey of [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol?
The InChIKey is WWEPHVNPNHMFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H34O/c1-32(2)18-19-33(3,4)31-21-27(15-17-30(31)32)29-20-26(24-12-10-23(22-34)11-13-24)14-16-28(29)25-8-6-5-7-9-25/h5-17,20-21,34H,18-19,22H2,1-4H3.
What are the key properties of [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol?
[4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol has a molecular weight of 446.63 g/mol, XLogP of 8.53, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-phenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]methanol is sourced from PubChem (CID 18768147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).