1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene

C16H18O3 — CID 139888688

IUPAC1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene
SMILESCOc1ccccc1OC[C@H](OC)c1ccccc1
InChIInChI=1S/C16H18O3/c1-17-14-10-6-7-11-15(14)19-12-16(18-2)13-8-4-3-5-9-13/h3-11,16H,12H2,1-2H3/t16-/m0/s1
InChIKeyZQUWWWZXRLBBHC-INIZCTEOSA-N
MW258.32 g/mol
LogP3.46
Rot. Bonds6

About 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene

1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene (PubChem CID 139888688) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene.

Molecular Properties

Compound Name1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene
PubChem CID139888688
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene
SMILESCOc1ccccc1OC[C@H](OC)c1ccccc1
InChIInChI=1S/C16H18O3/c1-17-14-10-6-7-11-15(14)19-12-16(18-2)13-8-4-3-5-9-13/h3-11,16H,12H2,1-2H3/t16-/m0/s1
InChIKeyZQUWWWZXRLBBHC-INIZCTEOSA-N
XLogP3.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene?
The IUPAC name of 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene (CID 139888688) is 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene.
What is the SMILES notation for 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene?
The canonical SMILES for 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene is COc1ccccc1OC[C@H](OC)c1ccccc1.
What is the InChIKey of 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene?
The InChIKey is ZQUWWWZXRLBBHC-INIZCTEOSA-N. The full InChI is InChI=1S/C16H18O3/c1-17-14-10-6-7-11-15(14)19-12-16(18-2)13-8-4-3-5-9-13/h3-11,16H,12H2,1-2H3/t16-/m0/s1.
What are the key properties of 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene?
1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene has a molecular weight of 258.32 g/mol, XLogP of 3.46, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene is sourced from PubChem (CID 139888688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).