4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol

C24H22O — CID 132552488

IUPAC4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol
SMILESC[C@H](C1=C(c2ccccc2)c2ccccc2CC1)c1ccc(O)cc1
InChIInChI=1S/C24H22O/c1-17(18-11-14-21(25)15-12-18)22-16-13-19-7-5-6-10-23(19)24(22)20-8-3-2-4-9-20/h2-12,14-15,17,25H,13,16H2,1H3/t17-/m0/s1
InChIKeyVEDPVORAYWZZIW-KRWDZBQOSA-N
MW326.44 g/mol
LogP5.94
Rot. Bonds3

About 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol

4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol (PubChem CID 132552488) has the molecular formula C24H22O and a molecular weight of 326.44 g/mol. Its IUPAC name is 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol.

Molecular Properties

Compound Name4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol
PubChem CID132552488
Molecular FormulaC24H22O
Molecular Weight326.44 g/mol
Exact Mass326.17
IUPAC Name4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol
SMILESC[C@H](C1=C(c2ccccc2)c2ccccc2CC1)c1ccc(O)cc1
InChIInChI=1S/C24H22O/c1-17(18-11-14-21(25)15-12-18)22-16-13-19-7-5-6-10-23(19)24(22)20-8-3-2-4-9-20/h2-12,14-15,17,25H,13,16H2,1H3/t17-/m0/s1
InChIKeyVEDPVORAYWZZIW-KRWDZBQOSA-N
XLogP5.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.44
LogP ≤ 55.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol?
The IUPAC name of 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol (CID 132552488) is 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol.
What is the SMILES notation for 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol?
The canonical SMILES for 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol is C[C@H](C1=C(c2ccccc2)c2ccccc2CC1)c1ccc(O)cc1.
What is the InChIKey of 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol?
The InChIKey is VEDPVORAYWZZIW-KRWDZBQOSA-N. The full InChI is InChI=1S/C24H22O/c1-17(18-11-14-21(25)15-12-18)22-16-13-19-7-5-6-10-23(19)24(22)20-8-3-2-4-9-20/h2-12,14-15,17,25H,13,16H2,1H3/t17-/m0/s1.
What are the key properties of 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol?
4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol has a molecular weight of 326.44 g/mol, XLogP of 5.94, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1S)-1-(1-phenyl-3,4-dihydronaphthalen-2-yl)ethyl]phenol is sourced from PubChem (CID 132552488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).