3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol

C16H16Cl2O — CID 107310734

IUPAC3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol
SMILESCc1ccccc1C(CO)Cc1cccc(Cl)c1Cl
InChIInChI=1S/C16H16Cl2O/c1-11-5-2-3-7-14(11)13(10-19)9-12-6-4-8-15(17)16(12)18/h2-8,13,19H,9-10H2,1H3
InChIKeyZOHKLFDLSKZUEV-UHFFFAOYSA-N
MW295.21 g/mol
LogP4.62
Rot. Bonds4

About 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol

3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol (PubChem CID 107310734) has the molecular formula C16H16Cl2O and a molecular weight of 295.21 g/mol. Its IUPAC name is 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol
PubChem CID107310734
Molecular FormulaC16H16Cl2O
Molecular Weight295.21 g/mol
Exact Mass294.06
IUPAC Name3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol
SMILESCc1ccccc1C(CO)Cc1cccc(Cl)c1Cl
InChIInChI=1S/C16H16Cl2O/c1-11-5-2-3-7-14(11)13(10-19)9-12-6-4-8-15(17)16(12)18/h2-8,13,19H,9-10H2,1H3
InChIKeyZOHKLFDLSKZUEV-UHFFFAOYSA-N
XLogP4.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-chloro-2-[3-chloro-2-(2-methylphenyl)propyl]benzene
CID 79419089
3-(3,4-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol
CID 79421828
N-[2-(2,3-dichlorophenyl)-1-(2-methylphenyl)ethyl]propan-1-amine
CID 107308428
2-(2,3-dichlorophenyl)-1-(2-ethylphenyl)ethanol
CID 107307475
2-[(2,3-dichlorophenyl)methyl]-3-(2-methylphenyl)propan-1-amine
CID 107309626
3-(5-ethylthiophen-2-yl)-2-(2-methylphenyl)propan-1-ol
CID 79424431
2-benzyl-3-(2,3-dichlorophenyl)propan-1-ol
CID 107310710
1-(3-chloro-2-methylphenyl)-2-(2,3-dichlorophenyl)ethanamine
CID 107312388
3-(4-bromo-2-fluorophenyl)-2-(2-methylphenyl)propan-1-ol
CID 79418016
3-(5-bromothiophen-2-yl)-2-(2-methylphenyl)propan-1-ol
CID 79420784
1-(2,3-dichlorophenyl)propan-2-ol;methanol
CID 144705964
(2R)-2-(aminomethyl)-3-(2,3-dichlorophenyl)propan-1-ol
CID 95001596

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol?
The IUPAC name of 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol (CID 107310734) is 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol.
What is the SMILES notation for 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol?
The canonical SMILES for 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol is Cc1ccccc1C(CO)Cc1cccc(Cl)c1Cl.
What is the InChIKey of 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol?
The InChIKey is ZOHKLFDLSKZUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2O/c1-11-5-2-3-7-14(11)13(10-19)9-12-6-4-8-15(17)16(12)18/h2-8,13,19H,9-10H2,1H3.
What are the key properties of 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol?
3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol has a molecular weight of 295.21 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol is sourced from PubChem (CID 107310734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).