[(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene

C19H20 — CID 10901004

IUPAC[(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene
SMILESCC(C)/C=C\C(=C\c1ccccc1)c1ccccc1
InChIInChI=1S/C19H20/c1-16(2)13-14-19(18-11-7-4-8-12-18)15-17-9-5-3-6-10-17/h3-16H,1-2H3/b14-13-,19-15-
InChIKeyQBIGHFMGMAPXRF-ISSFDRLWSA-N
MW248.37 g/mol
LogP5.44
Rot. Bonds4

About [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene

[(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene (PubChem CID 10901004) has the molecular formula C19H20 and a molecular weight of 248.37 g/mol. Its IUPAC name is [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene.

Molecular Properties

Compound Name[(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene
PubChem CID10901004
Molecular FormulaC19H20
Molecular Weight248.37 g/mol
Exact Mass248.16
IUPAC Name[(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene
SMILESCC(C)/C=C\C(=C\c1ccccc1)c1ccccc1
InChIInChI=1S/C19H20/c1-16(2)13-14-19(18-11-7-4-8-12-18)15-17-9-5-3-6-10-17/h3-16H,1-2H3/b14-13-,19-15-
InChIKeyQBIGHFMGMAPXRF-ISSFDRLWSA-N
XLogP5.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500248.37
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E)-4,5-diphenylpenta-2,4-dienoic acid
CID 56927310
(2E,4Z)-4,5-diphenylpenta-2,4-dienoic acid
CID 56927311
4,5-diphenylpenta-2,4-dienal
CID 54539333
4,5-diphenylpenta-2,4-dienoyl chloride
CID 54542291
tert-butyl (2E,4Z)-4,5-diphenylpenta-2,4-dienoate
CID 56653095
(E,2S)-3,4-diphenylbut-3-en-2-ol
CID 177489258
N-[4-(3,4-diphenylbuta-1,3-dienyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 54320320
(2E,4E)-N-methyl-4,5-diphenyl-N-prop-2-enylpenta-2,4-dien-1-amine
CID 88770312
(2E,4Z)-4,5-diphenylpenta-2,4-dienoyl azide
CID 56927308
[(3Z)-5-methyl-1-phenylhepta-1,3-dien-3-yl]benzene
CID 59892266
(Z)-2-(4-methoxyphenyl)-3-phenylprop-2-enal
CID 21283706
4-methyl-1,2-diphenylpent-1-en-3-one
CID 54502058

Frequently Asked Questions

What is the IUPAC name of [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene?
The IUPAC name of [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene (CID 10901004) is [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene.
What is the SMILES notation for [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene?
The canonical SMILES for [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene is CC(C)/C=C\C(=C\c1ccccc1)c1ccccc1.
What is the InChIKey of [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene?
The InChIKey is QBIGHFMGMAPXRF-ISSFDRLWSA-N. The full InChI is InChI=1S/C19H20/c1-16(2)13-14-19(18-11-7-4-8-12-18)15-17-9-5-3-6-10-17/h3-16H,1-2H3/b14-13-,19-15-.
What are the key properties of [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene?
[(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene has a molecular weight of 248.37 g/mol, XLogP of 5.44, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z,3Z)-5-methyl-1-phenylhexa-1,3-dien-2-yl]benzene is sourced from PubChem (CID 10901004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).