Neobavaisoflavone - 10mM in DMSO , CAS No.41060-15-5

CAS: 41060-15-5 Cat. No.: N580460 Summenformel: C20H18O4 Molekulargewicht: 322.35
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GRADE & PURITY 10mM in DMSO
Synonyms
A873151 | 7-Hydroxy-3-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-4H-chromen-4-one | Neobavaisoflavone | Oprea1_493755 | AKOS032948372 | MFCD00800660 | CHEBI:66614 | 7,4'-dihydroxy-3'-(gamma,gamma-dimethylallyl)isoflavone | 4',7-Dihydroxy-3'-(3-methyl-2-b
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
★
Size
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USA*
Price
Qty
1ml
N580460-1ml
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1 Auf Lager
74,54€
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
A873151 | 7-Hydroxy-3-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-4H-chromen-4-one | Neobavaisoflavone | Oprea1_493755 | AKOS032948372 | MFCD00800660 | CHEBI:66614 | 7,4'-dihydroxy-3'-(gamma,gamma-dimethylallyl)isoflavone | 4',7-Dihydroxy-3'-(3-methyl-2-b
Spezifikationen & Reinheit
10mM in DMSO
Storage
Store at -80°C
Verschickt in
Dry ice packs + Cold packs
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Namen und Kennungen
Pubchem Sid
Kanonisches Lächeln
CC(=CCC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O)C
IUPAC Name
7-hydroxy-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]chromen-4-one
InChIKey
OBGPEBYHGIUFBN-UHFFFAOYSA-N
INCHI
1S/C20H18O4/c1-12(2)3-4-14-9-13(5-8-18(14)22)17-11-24-19-10-15(21)6-7-16(19)20(17)23/h3,5-11,21-22H,4H2,1-2H3
Isomere SMILES
CC(=CCC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O)C
Molekulargewicht
322.35
Reaxy-Rn
4518386
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4518386&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
KlasseIsoflavonoids
SubclassIsoflav-2-enes
Intermediate Tree Nodes Not available
Direct ParentIsoflavones
Alternative Parents Hydroxyisoflavonoids  Chromones  Pyranones and derivatives  1-hydroxy-2-unsubstituted benzenoids  Benzene and substituted derivatives  Heteroaromatic compounds  Oxacyclic compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Isoflavone - Hydroxyisoflavonoid - Chromone - Benzopyran - 1-benzopyran - Pyranone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Pyran - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.
External Descriptors Isoflavonoids
3D-Struktur
Interaktives chemisches Strukturmodell





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Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemische und physikalische Eigenschaften
LöslichkeitDMSO : ≥ 31 mg/mL (96.17 mM)
EmpfindlichkeitMoisture sensitive;Light sensitive;Heat sensitive
Molekulargewicht322.400 g/mol
XLogP34.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass322.121 Da
Monoisotopic Mass322.121 Da
Topological Polar Surface Area66.800 Ų
Heavy Atom Count24
Formal Charge0
Complexity532.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Lösungsrechner
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