(4-tert-butylphenyl)-(4-propylphenyl)methanone

C20H24O — CID 24723303

IUPAC(4-tert-butylphenyl)-(4-propylphenyl)methanone
SMILESCCCc1ccc(C(=O)c2ccc(C(C)(C)C)cc2)cc1
InChIInChI=1S/C20H24O/c1-5-6-15-7-9-16(10-8-15)19(21)17-11-13-18(14-12-17)20(2,3)4/h7-14H,5-6H2,1-4H3
InChIKeySOOSSKMXBRANIK-UHFFFAOYSA-N
MW280.41 g/mol
LogP5.17
Rot. Bonds4

About (4-tert-butylphenyl)-(4-propylphenyl)methanone

(4-tert-butylphenyl)-(4-propylphenyl)methanone (PubChem CID 24723303) has the molecular formula C20H24O and a molecular weight of 280.41 g/mol. Its IUPAC name is (4-tert-butylphenyl)-(4-propylphenyl)methanone.

Molecular Properties

Compound Name(4-tert-butylphenyl)-(4-propylphenyl)methanone
PubChem CID24723303
Molecular FormulaC20H24O
Molecular Weight280.41 g/mol
Exact Mass280.18
IUPAC Name(4-tert-butylphenyl)-(4-propylphenyl)methanone
SMILESCCCc1ccc(C(=O)c2ccc(C(C)(C)C)cc2)cc1
InChIInChI=1S/C20H24O/c1-5-6-15-7-9-16(10-8-15)19(21)17-11-13-18(14-12-17)20(2,3)4/h7-14H,5-6H2,1-4H3
InChIKeySOOSSKMXBRANIK-UHFFFAOYSA-N
XLogP5.17
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.41
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-3-(4-propylphenyl)butan-2-one
CID 82282891
[4-(methylamino)phenyl]-(4-propylphenyl)methanone
CID 116917420
ethane;4-propylbenzoic acid
CID 91047964
[3-[[3,5-bis(4-tert-butylbenzoyl)phenyl]methyl]-5-(4-tert-butylbenzoyl)phenyl]-(4-tert-butylphenyl)methanone
CID 58299012
[4-(4-tert-butylbenzoyl)phenyl]-(4-methylphenyl)methanone
CID 145339056
N'-hydroxy-4-propylbenzohydrazide
CID 18359035
O-ethyl 5-tert-butyl-3-methyl-2-(4-propylbenzoyl)benzenecarbothioate
CID 142771295
[2-(4-butylbenzoyl)oxy-1,2-bis(4-tert-butylphenyl)ethenyl] 4-butylbenzoate
CID 138606475
3,3-difluoro-3-(4-propylphenyl)propanoic acid
CID 116838337
2-amino-2-phenyl-1-(4-propylphenyl)propan-1-one
CID 116563828
cadmium(2+);bis(4-propylbenzoate)
CID 101299923
bis[4-(4-tert-butylphenoxy)phenyl]methanone
CID 130415299

Frequently Asked Questions

What is the IUPAC name of (4-tert-butylphenyl)-(4-propylphenyl)methanone?
The IUPAC name of (4-tert-butylphenyl)-(4-propylphenyl)methanone (CID 24723303) is (4-tert-butylphenyl)-(4-propylphenyl)methanone.
What is the SMILES notation for (4-tert-butylphenyl)-(4-propylphenyl)methanone?
The canonical SMILES for (4-tert-butylphenyl)-(4-propylphenyl)methanone is CCCc1ccc(C(=O)c2ccc(C(C)(C)C)cc2)cc1.
What is the InChIKey of (4-tert-butylphenyl)-(4-propylphenyl)methanone?
The InChIKey is SOOSSKMXBRANIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O/c1-5-6-15-7-9-16(10-8-15)19(21)17-11-13-18(14-12-17)20(2,3)4/h7-14H,5-6H2,1-4H3.
What are the key properties of (4-tert-butylphenyl)-(4-propylphenyl)methanone?
(4-tert-butylphenyl)-(4-propylphenyl)methanone has a molecular weight of 280.41 g/mol, XLogP of 5.17, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butylphenyl)-(4-propylphenyl)methanone is sourced from PubChem (CID 24723303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).