1-(2,2-dimethylpropyl)-4-phenylbenzene

C17H20 — CID 23381564

IUPAC1-(2,2-dimethylpropyl)-4-phenylbenzene
SMILESCC(C)(C)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20/c1-17(2,3)13-14-9-11-16(12-10-14)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3
InChIKeySZTFINGXYDARLX-UHFFFAOYSA-N
MW224.35 g/mol
LogP4.94
Rot. Bonds2

About 1-(2,2-dimethylpropyl)-4-phenylbenzene

1-(2,2-dimethylpropyl)-4-phenylbenzene (PubChem CID 23381564) has the molecular formula C17H20 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-4-phenylbenzene.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)-4-phenylbenzene
PubChem CID23381564
Molecular FormulaC17H20
Molecular Weight224.35 g/mol
Exact Mass224.16
IUPAC Name1-(2,2-dimethylpropyl)-4-phenylbenzene
SMILESCC(C)(C)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20/c1-17(2,3)13-14-9-11-16(12-10-14)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3
InChIKeySZTFINGXYDARLX-UHFFFAOYSA-N
XLogP4.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,2-dimethylpropylbenzene;methanol
CID 157125736
[4-(2,2-dimethylpropyl)phenyl]-phenyldiazene
CID 134551069
2,4,6-tris[4-(2,2-dimethylpropyl)phenyl]-1,3,5-triazine
CID 140828529
2,2-dimethylpropane;2,2-dimethylpropylbenzene;2,2,3-trimethylbutane
CID 159235518
[5-(2,2-dimethylpropyl)-2-phenylphenyl]methanamine
CID 68534451
chloromethane;tridecakis(2,2-dimethylpropylbenzene);ethane;fluoromethane;methane;toluene;1,1,1-trifluoroethane
CID 158684200
1-[4-[4-(2-hydroxy-2-methylpropyl)phenyl]phenyl]-2-methylpropan-2-ol
CID 126511396
2,2-dimethylpropylbenzene;1-methoxy-2,2-dimethylpropane;methoxymethane
CID 160968956
(2,2-dimethyl-1-phenylpropyl)benzene;2,2-dimethylpropylbenzene
CID 158424284
(4S)-2,2,6,6-tetramethyl-4-[(4-phenylphenyl)methyl]heptan-3-one
CID 163649343
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-4-phenylbenzene?
The IUPAC name of 1-(2,2-dimethylpropyl)-4-phenylbenzene (CID 23381564) is 1-(2,2-dimethylpropyl)-4-phenylbenzene.
What is the SMILES notation for 1-(2,2-dimethylpropyl)-4-phenylbenzene?
The canonical SMILES for 1-(2,2-dimethylpropyl)-4-phenylbenzene is CC(C)(C)Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1-(2,2-dimethylpropyl)-4-phenylbenzene?
The InChIKey is SZTFINGXYDARLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20/c1-17(2,3)13-14-9-11-16(12-10-14)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3.
What are the key properties of 1-(2,2-dimethylpropyl)-4-phenylbenzene?
1-(2,2-dimethylpropyl)-4-phenylbenzene has a molecular weight of 224.35 g/mol, XLogP of 4.94, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)-4-phenylbenzene is sourced from PubChem (CID 23381564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).