1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol

C16H16Cl2O — CID 63411078

IUPAC1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol
SMILESCC(C)(c1ccccc1)C(O)c1cccc(Cl)c1Cl
InChIInChI=1S/C16H16Cl2O/c1-16(2,11-7-4-3-5-8-11)15(19)12-9-6-10-13(17)14(12)18/h3-10,15,19H,1-2H3
InChIKeyBEACNMRLPUJUEQ-UHFFFAOYSA-N
MW295.21 g/mol
LogP5.00
Rot. Bonds3

About 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol

1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol (PubChem CID 63411078) has the molecular formula C16H16Cl2O and a molecular weight of 295.21 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol
PubChem CID63411078
Molecular FormulaC16H16Cl2O
Molecular Weight295.21 g/mol
Exact Mass294.06
IUPAC Name1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol
SMILESCC(C)(c1ccccc1)C(O)c1cccc(Cl)c1Cl
InChIInChI=1S/C16H16Cl2O/c1-16(2,11-7-4-3-5-8-11)15(19)12-9-6-10-13(17)14(12)18/h3-10,15,19H,1-2H3
InChIKeyBEACNMRLPUJUEQ-UHFFFAOYSA-N
XLogP5.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.21
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-dichlorophenyl)-2-methylbutane-1,2-diol
CID 103448708
1-(2-fluorophenyl)-2-methyl-2-phenylpropan-1-ol
CID 55180552
1-(2,3-difluorophenyl)-2-methyl-2-phenylpropan-1-ol
CID 63989633
(1R,2R)-1-(2,3-dichlorophenyl)propane-1,2-diol;(1S,2S)-1-(2,3-dichlorophenyl)propane-1,2-diol;methane
CID 158468254
1-(2,5-dibromothiophen-3-yl)-2-methyl-2-phenylpropan-1-ol
CID 55198667
(1R)-1-(2,3-dichlorophenyl)-2,2-dimethylpropan-1-amine;hydrochloride
CID 171247920
1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol
CID 66459713
(2-tert-butylphenyl)-(2,3-dichlorophenyl)methanamine
CID 115851470
1-(2,6-dichlorophenyl)-3-methyl-3-phenylbutan-2-amine
CID 63420080
1-(2,3-dichlorophenyl)-2-(4-methylphenyl)ethanol
CID 62790994
1-(2-amino-3-chlorophenyl)-2,2-dimethylpropan-1-ol
CID 105467275
1-(2,3-dichlorophenyl)-3-methylbutan-1-ol
CID 62789609

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol?
The IUPAC name of 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol (CID 63411078) is 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol.
What is the SMILES notation for 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol?
The canonical SMILES for 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol is CC(C)(c1ccccc1)C(O)c1cccc(Cl)c1Cl.
What is the InChIKey of 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol?
The InChIKey is BEACNMRLPUJUEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2O/c1-16(2,11-7-4-3-5-8-11)15(19)12-9-6-10-13(17)14(12)18/h3-10,15,19H,1-2H3.
What are the key properties of 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol?
1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol has a molecular weight of 295.21 g/mol, XLogP of 5.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol is sourced from PubChem (CID 63411078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).