(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol

C16H16Cl2O2 — CID 107306824

IUPAC(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol
SMILESCc1ccc(OCc2cccc(Cl)c2Cl)c([C@@H](C)O)c1
InChIInChI=1S/C16H16Cl2O2/c1-10-6-7-15(13(8-10)11(2)19)20-9-12-4-3-5-14(17)16(12)18/h3-8,11,19H,9H2,1-2H3/t11-/m1/s1
InChIKeyVNJWVUACFWPVTN-LLVKDONJSA-N
MW311.21 g/mol
LogP4.93
Rot. Bonds4

About (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol

(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol (PubChem CID 107306824) has the molecular formula C16H16Cl2O2 and a molecular weight of 311.21 g/mol. Its IUPAC name is (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol
PubChem CID107306824
Molecular FormulaC16H16Cl2O2
Molecular Weight311.21 g/mol
Exact Mass310.05
IUPAC Name(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol
SMILESCc1ccc(OCc2cccc(Cl)c2Cl)c([C@@H](C)O)c1
InChIInChI=1S/C16H16Cl2O2/c1-10-6-7-15(13(8-10)11(2)19)20-9-12-4-3-5-14(17)16(12)18/h3-8,11,19H,9H2,1-2H3/t11-/m1/s1
InChIKeyVNJWVUACFWPVTN-LLVKDONJSA-N
XLogP4.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.21
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-[2-[(3-chloro-2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 102856296
1-[2-[(2-chloro-4-methylphenyl)methoxy]-5-methylphenyl]ethanol
CID 106864318
(1S)-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 78934333
(1R)-1-[2-[(2-methoxyphenyl)methoxy]-5-methylphenyl]ethanol
CID 63366482
1-[2-[(2,5-dimethylphenyl)methoxy]-5-methylphenyl]ethanol
CID 61481674
(1R)-1-[5-chloro-2-[(2-chloro-3-fluorophenyl)methoxy]phenyl]ethanol
CID 103954685
2-[(2,3-dichlorophenyl)methoxy]-4-methylaniline
CID 107305411
(1S)-1-[5-chloro-2-[(2,5-dimethylphenyl)methoxy]phenyl]ethanol
CID 78931561
(1S)-1-[2-[(2,6-difluorophenyl)methoxy]-5-methylphenyl]ethanol
CID 104984970
(1S)-1-[5-chloro-2-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethanol
CID 63364418
(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
CID 63364902
(1S)-1-[2-[(2,3-dichlorophenyl)methoxy]phenyl]propan-1-ol
CID 107306815

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol?
The IUPAC name of (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol (CID 107306824) is (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol?
The canonical SMILES for (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol is Cc1ccc(OCc2cccc(Cl)c2Cl)c([C@@H](C)O)c1.
What is the InChIKey of (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol?
The InChIKey is VNJWVUACFWPVTN-LLVKDONJSA-N. The full InChI is InChI=1S/C16H16Cl2O2/c1-10-6-7-15(13(8-10)11(2)19)20-9-12-4-3-5-14(17)16(12)18/h3-8,11,19H,9H2,1-2H3/t11-/m1/s1.
What are the key properties of (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol?
(1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol has a molecular weight of 311.21 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-[(2,3-dichlorophenyl)methoxy]-5-methylphenyl]ethanol is sourced from PubChem (CID 107306824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).