(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol

C15H16O3 — CID 63372514

IUPAC(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol
SMILESCOc1ccc(Oc2ccc([C@H](C)O)cc2)cc1
InChIInChI=1S/C15H16O3/c1-11(16)12-3-5-14(6-4-12)18-15-9-7-13(17-2)8-10-15/h3-11,16H,1-2H3/t11-/m0/s1
InChIKeySTQWEFSVBOCBAP-NSHDSACASA-N
MW244.29 g/mol
LogP3.54
Rot. Bonds4

About (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol

(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol (PubChem CID 63372514) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol
PubChem CID63372514
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol
SMILESCOc1ccc(Oc2ccc([C@H](C)O)cc2)cc1
InChIInChI=1S/C15H16O3/c1-11(16)12-3-5-14(6-4-12)18-15-9-7-13(17-2)8-10-15/h3-11,16H,1-2H3/t11-/m0/s1
InChIKeySTQWEFSVBOCBAP-NSHDSACASA-N
XLogP3.54
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 175713586
CID 175713586
(1R)-1-[4-(3,5-dimethoxyphenoxy)phenyl]ethanol
CID 78941782
1-[4-(3-methoxyphenoxy)phenyl]ethanol
CID 43506404
1-(1-iodoethyl)-4-methoxybenzene;1-(4-methoxyphenyl)ethanol
CID 158169844
1-(4-phenoxyphenyl)ethanol;hydrochloride
CID 67663526
(2S,3R)-3-(4-methoxyphenyl)butan-2-ol
CID 13481815
(2R)-1,1-bis(4-methoxyphenyl)propan-2-ol
CID 91746525
(1S)-1-[4-(4-methoxypyrimidin-2-yl)oxyphenyl]ethanol
CID 94830433
1-(2-chlorophenyl)ethanol;1-(4-methoxyphenyl)ethanol
CID 166540851
1-[4-[4-(1-hydroxy-2-methylpropyl)phenoxy]phenyl]-2-methylpropan-1-ol
CID 70467453
chloro-(4-methoxyphenyl)methanol
CID 130923369
(1R)-1-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]ethanol
CID 78944666

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol?
The IUPAC name of (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol (CID 63372514) is (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol.
What is the SMILES notation for (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol?
The canonical SMILES for (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol is COc1ccc(Oc2ccc([C@H](C)O)cc2)cc1.
What is the InChIKey of (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol?
The InChIKey is STQWEFSVBOCBAP-NSHDSACASA-N. The full InChI is InChI=1S/C15H16O3/c1-11(16)12-3-5-14(6-4-12)18-15-9-7-13(17-2)8-10-15/h3-11,16H,1-2H3/t11-/m0/s1.
What are the key properties of (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol?
(1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol has a molecular weight of 244.29 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[4-(4-methoxyphenoxy)phenyl]ethanol is sourced from PubChem (CID 63372514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).