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

C33H34O — CID 70214737

IUPAC[4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol
SMILESCC1(C)CCC(C)(C)c2cc(-c3ccccc3-c3ccc(-c4ccc(CO)cc4)cc3)ccc21
InChIInChI=1S/C33H34O/c1-32(2)19-20-33(3,4)31-21-27(17-18-30(31)32)29-8-6-5-7-28(29)26-15-13-25(14-16-26)24-11-9-23(22-34)10-12-24/h5-18,21,34H,19-20,22H2,1-4H3
InChIKeyODNGITSCDUPHAG-UHFFFAOYSA-N
MW446.63 g/mol
LogP8.53
Rot. Bonds4

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

[4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol (PubChem CID 70214737) has the molecular formula C33H34O and a molecular weight of 446.63 g/mol. Its IUPAC name is [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol
PubChem CID70214737
Molecular FormulaC33H34O
Molecular Weight446.63 g/mol
Exact Mass446.26
IUPAC Name[4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol
SMILESCC1(C)CCC(C)(C)c2cc(-c3ccccc3-c3ccc(-c4ccc(CO)cc4)cc3)ccc21
InChIInChI=1S/C33H34O/c1-32(2)19-20-33(3,4)31-21-27(17-18-30(31)32)29-8-6-5-7-28(29)26-15-13-25(14-16-26)24-11-9-23(22-34)10-12-24/h5-18,21,34H,19-20,22H2,1-4H3
InChIKeyODNGITSCDUPHAG-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

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-Anthracenemethanol
CID 73848
1-Pyrenemethanol
CID 104977
Benzo(a)pyrene-7,8-dihydrodiol
CID 25892
12-Methylbenz(a)anthracene-7-methanol
CID 11285
2-Naphthalenemethanol
CID 74128
Benzo(a)pyrene-6-methanol
CID 30544
7-Hydroxy-7,8,9,10-tetrahydrobenzo(a)pyrene
CID 97714
1-(1-Pyrenyl)ethanol
CID 119118
2-Pyrenemethanol
CID 146932
3-(5'-{2-[3,4-Bis(Hydroxymethyl)phenyl]ethyl}-2'-Methyl-2-Propylbiphenyl-4-Yl)pentan-3-Ol
CID 9847095
BENZO(a)PYRENE-4,5-DIOL, 4,5-DIHYDRO-, cis-
CID 40086
7-Methylbenz(a)anthracene-12-methanol
CID 11284

Frequently Asked Questions

What is the IUPAC name of [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol?
The IUPAC name of [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol (CID 70214737) is [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol.
What is the SMILES notation for [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol?
The canonical SMILES for [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol is CC1(C)CCC(C)(C)c2cc(-c3ccccc3-c3ccc(-c4ccc(CO)cc4)cc3)ccc21.
What is the InChIKey of [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol?
The InChIKey is ODNGITSCDUPHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H34O/c1-32(2)19-20-33(3,4)31-21-27(17-18-30(31)32)29-8-6-5-7-28(29)26-15-13-25(14-16-26)24-11-9-23(22-34)10-12-24/h5-18,21,34H,19-20,22H2,1-4H3.
What are the key properties of [4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol?
[4-[4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]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-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]phenyl]methanol is sourced from PubChem (CID 70214737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).