2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol

C17H19ClO — CID 60797871

IUPAC2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol
SMILESCC(C)c1ccc(C(O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H19ClO/c1-12(2)14-5-7-15(8-6-14)17(19)11-13-3-9-16(18)10-4-13/h3-10,12,17,19H,11H2,1-2H3
InChIKeyNSWQXALVSHIVAL-UHFFFAOYSA-N
MW274.79 g/mol
LogP4.74
Rot. Bonds4

About 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol

2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol (PubChem CID 60797871) has the molecular formula C17H19ClO and a molecular weight of 274.79 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol
PubChem CID60797871
Molecular FormulaC17H19ClO
Molecular Weight274.79 g/mol
Exact Mass274.11
IUPAC Name2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol
SMILESCC(C)c1ccc(C(O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H19ClO/c1-12(2)14-5-7-15(8-6-14)17(19)11-13-3-9-16(18)10-4-13/h3-10,12,17,19H,11H2,1-2H3
InChIKeyNSWQXALVSHIVAL-UHFFFAOYSA-N
XLogP4.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.79
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chlorophenyl)-1-(4-methylphenyl)ethanol
CID 60798981
1-(4-aminophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 106695441
1-(3-chloro-4-fluorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 63414664
1-(4-chlorophenyl)-2-phenylethanol
CID 10966396
2-(3,4-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethanol
CID 63410604
2-(4-chlorophenyl)-1-(3,5-dichlorophenyl)ethanol
CID 63519476
2-[(4-chlorophenyl)methyl]-3-(4-propan-2-ylphenyl)propan-1-amine
CID 63497236
2-(4-chlorophenyl)-1-(3,4-dichlorophenyl)ethanol
CID 61080644
1-[2-(bromomethyl)-3-(4-chlorophenyl)propyl]-4-propan-2-ylbenzene
CID 66041082
1-(2,6-dichlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 65150451
1-(4-chlorophenyl)-3-methylbutan-2-ol
CID 60797754
(2S)-3-chloro-4-(4-chlorophenyl)butan-2-ol
CID 131029128

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol (CID 60797871) is 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol is CC(C)c1ccc(C(O)Cc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol?
The InChIKey is NSWQXALVSHIVAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClO/c1-12(2)14-5-7-15(8-6-14)17(19)11-13-3-9-16(18)10-4-13/h3-10,12,17,19H,11H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol?
2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol has a molecular weight of 274.79 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-1-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 60797871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).