(1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol

C15H14Cl2O2 — CID 107094586

IUPAC(1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol
SMILESC[C@@H](O)c1cccc(OCc2cccc(Cl)c2Cl)c1
InChIInChI=1S/C15H14Cl2O2/c1-10(18)11-4-2-6-13(8-11)19-9-12-5-3-7-14(16)15(12)17/h2-8,10,18H,9H2,1H3/t10-/m1/s1
InChIKeyGWTIZYPNZLSCPQ-SNVBAGLBSA-N
MW297.18 g/mol
LogP4.63
Rot. Bonds4

About (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol

(1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol (PubChem CID 107094586) has the molecular formula C15H14Cl2O2 and a molecular weight of 297.18 g/mol. Its IUPAC name is (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol
PubChem CID107094586
Molecular FormulaC15H14Cl2O2
Molecular Weight297.18 g/mol
Exact Mass296.04
IUPAC Name(1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol
SMILESC[C@@H](O)c1cccc(OCc2cccc(Cl)c2Cl)c1
InChIInChI=1S/C15H14Cl2O2/c1-10(18)11-4-2-6-13(8-11)19-9-12-5-3-7-14(16)15(12)17/h2-8,10,18H,9H2,1H3/t10-/m1/s1
InChIKeyGWTIZYPNZLSCPQ-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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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol (CID 107094586) is (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol is C[C@@H](O)c1cccc(OCc2cccc(Cl)c2Cl)c1.
What is the InChIKey of (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol?
The InChIKey is GWTIZYPNZLSCPQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H14Cl2O2/c1-10(18)11-4-2-6-13(8-11)19-9-12-5-3-7-14(16)15(12)17/h2-8,10,18H,9H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-1-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol?
(1R)-1-[3-[(2,3-dichlorophenyl)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-[3-[(2,3-dichlorophenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 107094586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).