2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol

C16H13ClO — CID 174973723

IUPAC2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol
SMILESOC1c2ccccc2C=CC1c1ccc(Cl)cc1
InChIInChI=1S/C16H13ClO/c17-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)16(15)18/h1-10,15-16,18H
InChIKeyZNEVNWDQVZVQRI-UHFFFAOYSA-N
MW256.73 g/mol
LogP4.18
Rot. Bonds1

About 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol

2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol (PubChem CID 174973723) has the molecular formula C16H13ClO and a molecular weight of 256.73 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol
PubChem CID174973723
Molecular FormulaC16H13ClO
Molecular Weight256.73 g/mol
Exact Mass256.07
IUPAC Name2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol
SMILESOC1c2ccccc2C=CC1c1ccc(Cl)cc1
InChIInChI=1S/C16H13ClO/c17-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)16(15)18/h1-10,15-16,18H
InChIKeyZNEVNWDQVZVQRI-UHFFFAOYSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.73
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2S)-2-(4-hydroxyphenyl)-1,2-dihydronaphthalen-1-ol
CID 131848736
(1S,2R)-2-(3-chlorophenyl)-1,2-dihydronaphthalen-1-ol
CID 11807312
(1S,2S)-2-(3-methylphenyl)-1,2-dihydronaphthalen-1-ol
CID 132579451
methyl 4-[(1S,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl]benzoate
CID 177385810
2-[2-(4-chlorophenyl)ethynyl]-1,2-dihydronaphthalen-1-ol
CID 71666847
(1S,2R)-2-(3-methoxyphenyl)-1,2-dihydronaphthalen-1-ol
CID 15402081
(1R,2S)-2-methyl-1,2-dihydronaphthalen-1-ol
CID 13056069
(1R,2R)-2-methyl-1,2-dihydronaphthalen-1-ol
CID 11252162
(1R,2R)-2-amino-1,2-dihydronaphthalen-1-ol;hydrochloride
CID 71310849
hydron;1H-inden-1-ol
CID 174812636
(1S,2R)-6,7-dibromo-2-phenyl-1,2-dihydronaphthalen-1-ol
CID 11474456
(1S,2S)-6,7-difluoro-2-(4-fluorophenyl)-1,2-dihydronaphthalen-1-ol
CID 11311912

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol?
The IUPAC name of 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol (CID 174973723) is 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol.
What is the SMILES notation for 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol?
The canonical SMILES for 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol is OC1c2ccccc2C=CC1c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol?
The InChIKey is ZNEVNWDQVZVQRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClO/c17-13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)16(15)18/h1-10,15-16,18H.
What are the key properties of 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol?
2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol has a molecular weight of 256.73 g/mol, XLogP of 4.18, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-1,2-dihydronaphthalen-1-ol is sourced from PubChem (CID 174973723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).