1,2-diphenyl-3-prop-1-en-2-ylbenzene

C21H18 — CID 142394581

IUPAC1,2-diphenyl-3-prop-1-en-2-ylbenzene
SMILESC=C(C)c1cccc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C21H18/c1-16(2)19-14-9-15-20(17-10-5-3-6-11-17)21(19)18-12-7-4-8-13-18/h3-15H,1H2,2H3
InChIKeyOXZHFRYJTMGAPH-UHFFFAOYSA-N
MW270.38 g/mol
LogP6.05
Rot. Bonds3

About 1,2-diphenyl-3-prop-1-en-2-ylbenzene

1,2-diphenyl-3-prop-1-en-2-ylbenzene (PubChem CID 142394581) has the molecular formula C21H18 and a molecular weight of 270.38 g/mol. Its IUPAC name is 1,2-diphenyl-3-prop-1-en-2-ylbenzene.

Molecular Properties

Compound Name1,2-diphenyl-3-prop-1-en-2-ylbenzene
PubChem CID142394581
Molecular FormulaC21H18
Molecular Weight270.38 g/mol
Exact Mass270.14
IUPAC Name1,2-diphenyl-3-prop-1-en-2-ylbenzene
SMILESC=C(C)c1cccc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C21H18/c1-16(2)19-14-9-15-20(17-10-5-3-6-11-17)21(19)18-12-7-4-8-13-18/h3-15H,1H2,2H3
InChIKeyOXZHFRYJTMGAPH-UHFFFAOYSA-N
XLogP6.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.38
LogP ≤ 56.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-phenyl-6-prop-1-en-2-ylphenol
CID 154380547
5-methyl-1,2-diphenyl-3-prop-1-en-2-ylbenzene
CID 143163234
1,2-bis(prop-1-en-2-yl)benzene;hydrogen peroxide
CID 175029396
1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
CID 145437903
lithium 1,2-bis(prop-1-en-2-yl)benzene
CID 22717015
2,3-diphenylbenzamide;phosphoric acid
CID 68745056
3-phenyl-2-propan-2-yl-4-prop-1-en-2-ylphenol
CID 70579546
1-methyl-2,3-diphenylbenzene;sulfane
CID 174862423
azane;1-methyl-2,3-diphenylbenzene
CID 175031313
1-buta-2,3-dien-2-yl-2-phenylbenzene
CID 177461787
3-phenyl-2-(4-propylphenyl)benzoic acid
CID 175832931
1,2-bis(prop-1-en-2-yl)benzene;toluene
CID 173384676

Frequently Asked Questions

What is the IUPAC name of 1,2-diphenyl-3-prop-1-en-2-ylbenzene?
The IUPAC name of 1,2-diphenyl-3-prop-1-en-2-ylbenzene (CID 142394581) is 1,2-diphenyl-3-prop-1-en-2-ylbenzene.
What is the SMILES notation for 1,2-diphenyl-3-prop-1-en-2-ylbenzene?
The canonical SMILES for 1,2-diphenyl-3-prop-1-en-2-ylbenzene is C=C(C)c1cccc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 1,2-diphenyl-3-prop-1-en-2-ylbenzene?
The InChIKey is OXZHFRYJTMGAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18/c1-16(2)19-14-9-15-20(17-10-5-3-6-11-17)21(19)18-12-7-4-8-13-18/h3-15H,1H2,2H3.
What are the key properties of 1,2-diphenyl-3-prop-1-en-2-ylbenzene?
1,2-diphenyl-3-prop-1-en-2-ylbenzene has a molecular weight of 270.38 g/mol, XLogP of 6.05, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenyl-3-prop-1-en-2-ylbenzene is sourced from PubChem (CID 142394581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).