5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol

C17H16O2 — CID 125487184

IUPAC5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol
SMILESOc1ccc(CC2=CCCc3cc(O)ccc32)cc1
InChIInChI=1S/C17H16O2/c18-15-6-4-12(5-7-15)10-13-2-1-3-14-11-16(19)8-9-17(13)14/h2,4-9,11,18-19H,1,3,10H2
InChIKeyWBYQWSIAVZCOFL-UHFFFAOYSA-N
MW252.31 g/mol
LogP3.67
Rot. Bonds2

About 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol

5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol (PubChem CID 125487184) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol
PubChem CID125487184
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol
SMILESOc1ccc(CC2=CCCc3cc(O)ccc32)cc1
InChIInChI=1S/C17H16O2/c18-15-6-4-12(5-7-15)10-13-2-1-3-14-11-16(19)8-9-17(13)14/h2,4-9,11,18-19H,1,3,10H2
InChIKeyWBYQWSIAVZCOFL-UHFFFAOYSA-N
XLogP3.67
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-chloropropyl)-7,8-dihydronaphthalen-2-ol
CID 42644023
4-[(4-hydroxyphenyl)methyl]phenol
CID 12111
1-(methylaminomethyl)-3H-inden-5-ol
CID 105436179
6-hydroxy-2-[(4-hydroxyphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-one
CID 11623142
2-(6-hydroxy-3,4-dihydronaphthalen-1-yl)-2-methylpropanoic acid
CID 105490846
7-(4-hydroxybutyl)-9,10-dihydrophenanthren-2-ol
CID 66798061
9,10-dihydrophenanthrene-2,6-diol
CID 163031531
4-(4-hydroxyphenyl)-3-[(4-hydroxyphenyl)methyl]phenol
CID 155168344
2-hydroxy-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
CID 11959102
9,10-dihydrophenanthren-2-ol;ethane
CID 91093084
(5-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanol
CID 70827641
7-methyl-4-propyl-1,2-dihydronaphthalene
CID 145183913

Frequently Asked Questions

What is the IUPAC name of 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol?
The IUPAC name of 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol (CID 125487184) is 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol.
What is the SMILES notation for 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol?
The canonical SMILES for 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol is Oc1ccc(CC2=CCCc3cc(O)ccc32)cc1.
What is the InChIKey of 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol?
The InChIKey is WBYQWSIAVZCOFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O2/c18-15-6-4-12(5-7-15)10-13-2-1-3-14-11-16(19)8-9-17(13)14/h2,4-9,11,18-19H,1,3,10H2.
What are the key properties of 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol?
5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol has a molecular weight of 252.31 g/mol, XLogP of 3.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-hydroxyphenyl)methyl]-7,8-dihydronaphthalen-2-ol is sourced from PubChem (CID 125487184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).