4,4-dimethyl-2,3-diphenylpentane-2,3-diol

C19H24O2 — CID 174973746

IUPAC4,4-dimethyl-2,3-diphenylpentane-2,3-diol
SMILESCC(C)(C)C(O)(c1ccccc1)C(C)(O)c1ccccc1
InChIInChI=1S/C19H24O2/c1-17(2,3)19(21,16-13-9-6-10-14-16)18(4,20)15-11-7-5-8-12-15/h5-14,20-21H,1-4H3
InChIKeyMXBGKYUEWJJQKG-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.83
Rot. Bonds3

About 4,4-dimethyl-2,3-diphenylpentane-2,3-diol

4,4-dimethyl-2,3-diphenylpentane-2,3-diol (PubChem CID 174973746) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 4,4-dimethyl-2,3-diphenylpentane-2,3-diol.

Molecular Properties

Compound Name4,4-dimethyl-2,3-diphenylpentane-2,3-diol
PubChem CID174973746
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name4,4-dimethyl-2,3-diphenylpentane-2,3-diol
SMILESCC(C)(C)C(O)(c1ccccc1)C(C)(O)c1ccccc1
InChIInChI=1S/C19H24O2/c1-17(2,3)19(21,16-13-9-6-10-14-16)18(4,20)15-11-7-5-8-12-15/h5-14,20-21H,1-4H3
InChIKeyMXBGKYUEWJJQKG-UHFFFAOYSA-N
XLogP3.83
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1,1,3,3,3-hexafluoro-2-methylpropan-2-ol;1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-ol
CID 157119135
3-hydroxy-2,2-dimethyl-3-phenylbutanoic acid
CID 12570468
hydrogen peroxide;2,3,3-trimethylbutan-2-ylbenzene
CID 23026515
3-methoxy-2,3-diphenylbutan-2-ol
CID 3395875
3,3,4-trimethyl-2-phenylpent-4-en-2-ol
CID 101413424
(2S,4R)-2,4-diphenylpentane-2,4-diol
CID 139037078
magnesium;hydride;2-phenylpropan-2-ol
CID 175301380
1,1,1,3,3,4,4,4-octafluoro-2-phenylbutan-2-ol
CID 14401239
1-[2-(1-hydroxy-1-phenylethyl)phenyl]-1-phenylethanol
CID 139663259
CID 171375456
CID 171375456
2-phenylpropan-2-ylbenzene
CID 13065
(2,2-dimethyl-1,1-diphenylpropyl)benzene;bis(2,2-dimethylpropane)
CID 162197471

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-2,3-diphenylpentane-2,3-diol?
The IUPAC name of 4,4-dimethyl-2,3-diphenylpentane-2,3-diol (CID 174973746) is 4,4-dimethyl-2,3-diphenylpentane-2,3-diol.
What is the SMILES notation for 4,4-dimethyl-2,3-diphenylpentane-2,3-diol?
The canonical SMILES for 4,4-dimethyl-2,3-diphenylpentane-2,3-diol is CC(C)(C)C(O)(c1ccccc1)C(C)(O)c1ccccc1.
What is the InChIKey of 4,4-dimethyl-2,3-diphenylpentane-2,3-diol?
The InChIKey is MXBGKYUEWJJQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-17(2,3)19(21,16-13-9-6-10-14-16)18(4,20)15-11-7-5-8-12-15/h5-14,20-21H,1-4H3.
What are the key properties of 4,4-dimethyl-2,3-diphenylpentane-2,3-diol?
4,4-dimethyl-2,3-diphenylpentane-2,3-diol has a molecular weight of 284.40 g/mol, XLogP of 3.83, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-2,3-diphenylpentane-2,3-diol is sourced from PubChem (CID 174973746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).