(1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol

C15H14Cl2O2 — CID 63364382

IUPAC(1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol
SMILESC[C@@H](O)c1cc(Cl)ccc1OCc1cccc(Cl)c1
InChIInChI=1S/C15H14Cl2O2/c1-10(18)14-8-13(17)5-6-15(14)19-9-11-3-2-4-12(16)7-11/h2-8,10,18H,9H2,1H3/t10-/m1/s1
InChIKeyJNEJPXDYETXTTC-SNVBAGLBSA-N
MW297.18 g/mol
LogP4.63
Rot. Bonds4

About (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol

(1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol (PubChem CID 63364382) has the molecular formula C15H14Cl2O2 and a molecular weight of 297.18 g/mol. Its IUPAC name is (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol
PubChem CID63364382
Molecular FormulaC15H14Cl2O2
Molecular Weight297.18 g/mol
Exact Mass296.04
IUPAC Name(1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol
SMILESC[C@@H](O)c1cc(Cl)ccc1OCc1cccc(Cl)c1
InChIInChI=1S/C15H14Cl2O2/c1-10(18)14-8-13(17)5-6-15(14)19-9-11-3-2-4-12(16)7-11/h2-8,10,18H,9H2,1H3/t10-/m1/s1
InChIKeyJNEJPXDYETXTTC-SNVBAGLBSA-N
XLogP4.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[5-chloro-2-[(3-methylphenyl)methoxy]phenyl]ethanol
CID 55031626
1-[5-chloro-2-[(3,4-difluorophenyl)methoxy]phenyl]ethanol
CID 82918483
(1R)-1-[5-chloro-2-[(3-nitrophenyl)methoxy]phenyl]ethanol
CID 63364333
(1R)-1-[2-[(3-chlorophenyl)methoxy]-5-nitrophenyl]ethanol
CID 104890071
(1S)-1-[5-chloro-2-[(3-chloro-4-fluorophenyl)methoxy]phenyl]ethanol
CID 103038370
(1S)-1-[5-chloro-2-[(4-propan-2-ylphenyl)methoxy]phenyl]ethanol
CID 78944255
(1S)-1-[5-chloro-2-[(4-iodophenyl)methoxy]phenyl]ethanol
CID 79009046
(1R)-1-[5-chloro-2-(2-phenylethoxy)phenyl]ethanol
CID 78931026
(1R)-1-[5-chloro-2-[(2-chloro-3-fluorophenyl)methoxy]phenyl]ethanol
CID 103954685
(1S)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]ethanol
CID 78944605
(1S)-1-[2-[(3-chlorophenyl)methoxy]phenyl]ethanamine
CID 78936371
(1R)-1-[2-[(3-chlorophenyl)methoxy]phenyl]ethanamine
CID 63367090

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol (CID 63364382) is (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol is C[C@@H](O)c1cc(Cl)ccc1OCc1cccc(Cl)c1.
What is the InChIKey of (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol?
The InChIKey is JNEJPXDYETXTTC-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H14Cl2O2/c1-10(18)14-8-13(17)5-6-15(14)19-9-11-3-2-4-12(16)7-11/h2-8,10,18H,9H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol?
(1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol has a molecular weight of 297.18 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-chloro-2-[(3-chlorophenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 63364382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).