3-methoxy-2,3-diphenylbutan-2-ol

C17H20O2 — CID 3395875

IUPAC3-methoxy-2,3-diphenylbutan-2-ol
SMILESCOC(C)(c1ccccc1)C(C)(O)c1ccccc1
InChIInChI=1S/C17H20O2/c1-16(18,14-10-6-4-7-11-14)17(2,19-3)15-12-8-5-9-13-15/h4-13,18H,1-3H3
InChIKeyNACJJXQFPDJAQO-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.46
Rot. Bonds4

About 3-methoxy-2,3-diphenylbutan-2-ol

3-methoxy-2,3-diphenylbutan-2-ol (PubChem CID 3395875) has the molecular formula C17H20O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 3-methoxy-2,3-diphenylbutan-2-ol.

Molecular Properties

Compound Name3-methoxy-2,3-diphenylbutan-2-ol
PubChem CID3395875
Molecular FormulaC17H20O2
Molecular Weight256.35 g/mol
Exact Mass256.15
IUPAC Name3-methoxy-2,3-diphenylbutan-2-ol
SMILESCOC(C)(c1ccccc1)C(C)(O)c1ccccc1
InChIInChI=1S/C17H20O2/c1-16(18,14-10-6-4-7-11-14)17(2,19-3)15-12-8-5-9-13-15/h4-13,18H,1-3H3
InChIKeyNACJJXQFPDJAQO-UHFFFAOYSA-N
XLogP3.46
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-methoxy-1-phenylethanol
CID 141414609
(3-methoxy-2-methyl-3-phenylbutan-2-yl) hydrogen carbonate
CID 90300640
aluminum;methoxy(phenyl)methanediol;trichloride
CID 173442251
4,4-dimethyl-2,3-diphenylpentane-2,3-diol
CID 174973746
3-hydroxy-2,2-dimethyl-3-phenylbutanoic acid
CID 12570468
(2R,3R,4R,5R)-2,5-dimethoxy-2,5-diphenylhexane-3,4-diol
CID 101412286
(1-fluoro-1-methoxyethyl)benzene
CID 89466800
(3-acetyloxy-2,3-diphenylbutan-2-yl) acetate
CID 135011938
3,3,4-trimethyl-2-phenylpent-4-en-2-ol
CID 101413424
1,1,1-trifluoro-2-(4-phenoxyphenyl)propan-2-ol
CID 13463093
(2S,4R)-2,4-diphenylpentane-2,4-diol
CID 139037078
magnesium;hydride;2-phenylpropan-2-ol
CID 175301380

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2,3-diphenylbutan-2-ol?
The IUPAC name of 3-methoxy-2,3-diphenylbutan-2-ol (CID 3395875) is 3-methoxy-2,3-diphenylbutan-2-ol.
What is the SMILES notation for 3-methoxy-2,3-diphenylbutan-2-ol?
The canonical SMILES for 3-methoxy-2,3-diphenylbutan-2-ol is COC(C)(c1ccccc1)C(C)(O)c1ccccc1.
What is the InChIKey of 3-methoxy-2,3-diphenylbutan-2-ol?
The InChIKey is NACJJXQFPDJAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-16(18,14-10-6-4-7-11-14)17(2,19-3)15-12-8-5-9-13-15/h4-13,18H,1-3H3.
What are the key properties of 3-methoxy-2,3-diphenylbutan-2-ol?
3-methoxy-2,3-diphenylbutan-2-ol has a molecular weight of 256.35 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2,3-diphenylbutan-2-ol is sourced from PubChem (CID 3395875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).