1,7-Diphenyl-4-hepten-3-one - ≥95%(LC/MS-UV) , CAS No.79559-59-4

CAS: 79559-59-4 Cat. No.: D463963 Molecular Weight: 264.36
AVAILABLE TO ORDER
GRADE & PURITY ≥95%(LC/MS-UV)
Synonyms
ACon1_001294 | DAH-3-Keto-4-en | SCHEMBL6373065 | 1,7-diphenyl-4-hepten-3-one | BRD-K64408267-001-01-9 | FS-7901 | (4E)-1,7-diphenyl-hepta-4-en-3-on | NCGC00180658-01 | CHEBI:173877 | BDBM50556723 | 4-Hepten-3-one, 1,7-diphenyl- | (4E)-1,7-diphenylhept-4-
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1mg
D463963-1mg
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Why this grade

≥95%(LC/MS-UV) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Description

Natural product derived from plant source.}

Specifications

Synonyms
ACon1_001294 | DAH-3-Keto-4-en | SCHEMBL6373065 | 1, 7-diphenyl-4-hepten-3-one | BRD-K64408267-001-01-9 | FS-7901 | (4E)-1, 7-diphenyl-hepta-4-en-3-on | NCGC00180658-01 | CHEBI:173877 | BDBM50556723 | 4-Hepten-3-one, 1, 7-diphenyl- | (4E)-1, 7-diphenylhept-4-
Specifications & Purity
≥95%(LC/MS-UV)
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%(LC/MS-UV)
Names and Identifiers
Canonical SmilesC1=CC=C(C=C1)CCC=CC(=O)CCC2=CC=CC=C2
IUPAC Name(E)-1,7-diphenylhept-4-en-3-one
InChIKeyUDNMYDZHPMNIEQ-RIYZIHGNSA-N
INCHI1S/C19H20O/c20-19(16-15-18-11-5-2-6-12-18)14-8-7-13-17-9-3-1-4-10-17/h1-6,8-12,14H,7,13,15-16H2/b14-8+
Isomeric SMILES C1=CC=C(C=C1)CC/C=C/C(=O)CCC2=CC=CC=C2
Molecular Weight 264.36
Reaxy-Rn 5743529
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5743529&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
ClassDiarylheptanoids
SubclassLinear diarylheptanoids
Intermediate Tree Nodes Not available
Direct ParentLinear diarylheptanoids
Alternative Parents Benzene and substituted derivatives  Enones  Acryloyl compounds  Ketones  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Linear 1,7-diphenylheptane skeleton - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RAW264.7 (28094 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Solubility DMSO: 1mg/mL
Flash Point(°F)Not applicable
Flash Point(°C)Not applicable
Molecular Weight264.400 g/mol
XLogP34.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count7
Exact Mass264.151 Da
Monoisotopic Mass264.151 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count20
Formal Charge0
Complexity293.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
Solution Calculators
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