3-Chlorophenylglyoxal hydrate - ≥95% , CAS No.177288-16-3

CAS: 177288-16-3 Cat. No.: C191598 Fórmula: C8H7ClO3 Peso molecular: 186.59 Número EC: 689-321-0
Disponible para pedir
GRADE & PURITY ≥95%
Synonyms
3-Chlorophenylglyoxal hydrate|177288-16-3|2-(3-chlorophenyl)-2-oxoacetaldehyde;hydrate|MFCD08705874|1082715-90-9|2-(3-chlorophenyl)-2-oxoacetaldehyde hydrate|2-(3-Chlorophenyl)-2-oxo-acetaldehyde hydrate|SCHEMBL8938090|DTXSID80625634|MFCD05864649|AKOS0160
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
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Size
USA
Alemania (EU)*
Price
Qty
1g
C191598-1g
Fabricado bajo pedido · 8–12 semanas
39,90US$
5g
C191598-5g
Fabricado bajo pedido · 8–12 semanas
149,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,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

Sinónimos
3-Chlorophenylglyoxal hydrate | 177288-16-3 | 2-(3-chlorophenyl)-2-oxoacetaldehyde;hydrate | MFCD08705874 | 1082715-90-9 | 2-(3-chlorophenyl)-2-oxoacetaldehyde hydrate | 2-(3-Chlorophenyl)-2-oxo-acetaldehyde hydrate | SCHEMBL8938090 | DTXSID80625634 | MFCD05864649 | AKOS0160
Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C,Protected from light,Argon charged
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥95%
Nombres e identificadores
Sonrisas canónicasC1=CC(=CC(=C1)Cl)C(=O)C=O.O
IUPAC Name2-(3-chlorophenyl)-2-oxoacetaldehyde;hydrate
InChIKeyQDPIMXWMDQVBKT-UHFFFAOYSA-N
INCHI1S/C8H5ClO2.H2O/c9-7-3-1-2-6(4-7)8(11)5-10;/h1-5H;1H2
Isómeros SMILES C1=CC(=CC(=C1)Cl)C(=O)C=O.O
Peso molecular 186.59
Reaxy-Rn 14926763
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14926763&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
ClaseBenzene and substituted derivatives
SubclassPhenylacetaldehydes
Intermediate Tree Nodes Not available
Direct ParentPhenylacetaldehydes
Alternative Parents Benzoyl derivatives  Aryl ketones  Chlorobenzenes  Aryl chlorides  Alpha ketoaldehydes  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenylacetaldehyde - Benzoyl - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Alpha-ketoaldehyde - Ketone - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aldehyde - Organochloride - Organooxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as phenylacetaldehydes. These are compounds containing a phenylacetaldehyde moiety, which consists of a phenyl group substituted at the second position by an acetalydehyde.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
SensibilidadLight sensitive ;Air sensitive
Peso molecular186.590 g/mol
XLogP3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass186.008 Da
Monoisotopic Mass186.008 Da
Topological Polar Surface Area35.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity167.000
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 Count2
Calculadoras de soluciones
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