7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol

C19H22O — CID 140664493

IUPAC7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol
SMILESCC(C)(C)c1ccc(-c2cccc3c2C(O)CC3)cc1
InChIInChI=1S/C19H22O/c1-19(2,3)15-10-7-13(8-11-15)16-6-4-5-14-9-12-17(20)18(14)16/h4-8,10-11,17,20H,9,12H2,1-3H3
InChIKeyBGEUMPHVVJKWCS-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.63
Rot. Bonds1

About 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol

7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol (PubChem CID 140664493) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol
PubChem CID140664493
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol
SMILESCC(C)(C)c1ccc(-c2cccc3c2C(O)CC3)cc1
InChIInChI=1S/C19H22O/c1-19(2,3)15-10-7-13(8-11-15)16-6-4-5-14-9-12-17(20)18(14)16/h4-8,10-11,17,20H,9,12H2,1-3H3
InChIKeyBGEUMPHVVJKWCS-UHFFFAOYSA-N
XLogP4.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-(hydroxymethyl)-2,3-dihydro-1H-inden-1-ol
CID 15329434
4-(4-tert-butylphenyl)-2-methyl-2,3-dihydro-1H-indene
CID 160681776
(1S)-7-bromo-2,3-dihydro-1H-inden-1-ol
CID 129246818
2-tert-butyl-4-(4-tert-butylphenyl)-1H-indene
CID 87188622
4-(4-tert-butylphenyl)-2-(4-methylphenyl)-1H-indene
CID 87188383
1,4-bis(4-tert-butylphenyl)naphthalene
CID 123481845
1-tert-butyl-4-(2-iodophenyl)benzene
CID 22914033
2-(4-tert-butylphenyl)benzenethiol
CID 22566543
[2-(4-tert-butylphenyl)phenyl]phosphane
CID 58067255
tris(2,3-dihydro-1H-inden-1-ol);ethane
CID 19770523
7-propoxy-2,3-dihydro-1H-inden-1-ol
CID 126991757
(3-hydroxy-2,3-dihydro-1H-inden-4-yl) acetate
CID 19864735

Frequently Asked Questions

What is the IUPAC name of 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol (CID 140664493) is 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol is CC(C)(C)c1ccc(-c2cccc3c2C(O)CC3)cc1.
What is the InChIKey of 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is BGEUMPHVVJKWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-19(2,3)15-10-7-13(8-11-15)16-6-4-5-14-9-12-17(20)18(14)16/h4-8,10-11,17,20H,9,12H2,1-3H3.
What are the key properties of 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol?
7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 266.38 g/mol, XLogP of 4.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-tert-butylphenyl)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 140664493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).