4-Bromo-7-hydroxy-1-indanone - ≥97% , CAS No.81945-13-3

CAS: 81945-13-3 Cat. No.: B469706 Summenformel: C9H7BrO2 Molekulargewicht: 227.05 EG-Nummer: 685-093-1
Zu bestellen verfügbar
GRADE & PURITY ≥97%
Synonyms
4-bromo-7-hydroxy-2,3-dihydro-1H-inden-1-one | STK366089 | AS-66137 | 1H-Inden-1-one,4-bromo-2,3-dihydro-7-hydroxy | A864476 | Y11690 | MFCD00463881 | SCHEMBL2294753 | 4-bromo-7-hydroxy-2,3-dihydroinden-1-one | 4-Bromo-2,3-dihydro-7-hydroxy-1H-inden-1-one
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
★
Size
Deutschland (EU)
USA*
Price
Qty
250mg
B469706-250mg
Auf Bestellung · 8–12 Wochen
25,08€
1g
B469706-1g
Auf Bestellung · 8–12 Wochen
69,33€
5g
B469706-5g
Auf Bestellung · 8–12 Wochen
242,88€
25g
B469706-25g
Auf Bestellung · 8–12 Wochen
858,97€
Enter a quantity for the sizes you want to add.
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
4-bromo-7-hydroxy-2,3-dihydro-1H-inden-1-one | STK366089 | AS-66137 | 1H-Inden-1-one,4-bromo-2,3-dihydro-7-hydroxy | A864476 | Y11690 | MFCD00463881 | SCHEMBL2294753 | 4-bromo-7-hydroxy-2,3-dihydroinden-1-one | 4-Bromo-2,3-dihydro-7-hydroxy-1H-inden-1-one
Spezifikationen & Reinheit
≥97%
Storage
Store at 2-8°C,Argon charged
Verschickt in
Wet ice
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Reinheit
≥97%
Namen und Kennungen
Kanonisches Lächeln
C1CC(=O)C2=C(C=CC(=C21)Br)O
IUPAC Name
4-bromo-7-hydroxy-2,3-dihydroinden-1-one
InChIKey
ZTWBCFVYMDBPPD-UHFFFAOYSA-N
INCHI
1S/C9H7BrO2/c10-6-2-4-8(12)9-5(6)1-3-7(9)11/h2,4,12H,1,3H2
Isomere SMILES
C1CC(=O)C2=C(C=CC(=C21)Br)O
Molekulargewicht
227.05
Reaxy-Rn
1240295
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1240295&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
SuperclassBenzenoids
KlasseIndanes
SubclassIndanones
Intermediate Tree Nodes Not available
Direct ParentIndanones
Alternative Parents P-bromophenols  Aryl alkyl ketones  1-hydroxy-2-unsubstituted benzenoids  Aryl bromides  Vinylogous acids  Organobromides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homopolycyclic compounds
Substituents Indanone - 4-halophenol - 4-bromophenol - Aryl ketone - Aryl alkyl ketone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Aryl halide - Aryl bromide - Vinylogous acid - Ketone - Organooxygen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as indanones. These are compounds containing an indane ring bearing a ketone group.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemische und physikalische Eigenschaften
Empfindlichkeitair sensitive
Flammpunkt (°F)Not applicable
Flammpunkt (°C)Not applicable
Schmelzpunkt (°C)144-148℃
Molekulargewicht227.050 g/mol
XLogP32.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass225.963 Da
Monoisotopic Mass225.963 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count12
Formal Charge0
Complexity205.000
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
Lösungsrechner
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