(Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene

C26H30 — CID 145212075

IUPAC(Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene
SMILESC/C=C\C.C=CC.Cc1cccc(-c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C19H16.C4H8.C3H6/c1-15-6-5-9-19(14-15)18-12-10-17(11-13-18)16-7-3-2-4-8-16;1-3-4-2;1-3-2/h2-14H,1H3;3-4H,1-2H3;3H,1H2,2H3/b;4-3-;
InChIKeyIGWCQSVHGBJNCK-LWFKIUJUSA-N
MW342.53 g/mol
LogP8.10
Rot. Bonds2

About (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene

(Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene (PubChem CID 145212075) has the molecular formula C26H30 and a molecular weight of 342.53 g/mol. Its IUPAC name is (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene.

Molecular Properties

Compound Name(Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene
PubChem CID145212075
Molecular FormulaC26H30
Molecular Weight342.53 g/mol
Exact Mass342.23
IUPAC Name(Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene
SMILESC/C=C\C.C=CC.Cc1cccc(-c2ccc(-c3ccccc3)cc2)c1
InChIInChI=1S/C19H16.C4H8.C3H6/c1-15-6-5-9-19(14-15)18-12-10-17(11-13-18)16-7-3-2-4-8-16;1-3-4-2;1-3-2/h2-14H,1H3;3-4H,1-2H3;3H,1H2,2H3/b;4-3-;
InChIKeyIGWCQSVHGBJNCK-LWFKIUJUSA-N
XLogP8.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.53
LogP ≤ 58.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-methyl-3-(3-phenylphenyl)benzene;prop-1-ene
CID 142561273
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
ethane;1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 142439051
1-methyl-3-[3-[3-(4-phenylphenyl)phenyl]phenyl]benzene
CID 153438411
ethene;1-methyl-3-phenylbenzene
CID 142622149
ethane;1-methyl-3-phenylbenzene
CID 142040878
1-(3-methylphenyl)-3-phenyl-5-(3-phenylphenyl)benzene
CID 123280286
ethane;1-methyl-3-(3-phenylphenyl)benzene
CID 163289488
1-(3,5-diphenylphenyl)-3-(3-methylphenyl)-5-phenylbenzene
CID 123283333
ethane;methane;1-methyl-3-phenylbenzene
CID 144644852
methanamine;1-methyl-3-phenylbenzene
CID 145414985
1,1'-biphenyl;1,3-diphenylbenzene;1,4-diphenylbenzene;ethane;toluene
CID 165006736

Frequently Asked Questions

What is the IUPAC name of (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene?
The IUPAC name of (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene (CID 145212075) is (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene.
What is the SMILES notation for (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene?
The canonical SMILES for (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene is C/C=C\C.C=CC.Cc1cccc(-c2ccc(-c3ccccc3)cc2)c1.
What is the InChIKey of (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene?
The InChIKey is IGWCQSVHGBJNCK-LWFKIUJUSA-N. The full InChI is InChI=1S/C19H16.C4H8.C3H6/c1-15-6-5-9-19(14-15)18-12-10-17(11-13-18)16-7-3-2-4-8-16;1-3-4-2;1-3-2/h2-14H,1H3;3-4H,1-2H3;3H,1H2,2H3/b;4-3-;.
What are the key properties of (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene?
(Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene has a molecular weight of 342.53 g/mol, XLogP of 8.10, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-ene;1-methyl-3-(4-phenylphenyl)benzene;prop-1-ene is sourced from PubChem (CID 145212075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).