3-Chloropropionitrile solution - 1000μg/ml,in Purge and Trap Methanol , CAS No.542-76-7

CAS: 542-76-7 Cat. No.: C141146 Peso molecular: 89.52 Número EC: 208-827-0
Disponible para pedir
GRADE & PURITY 1000μg/ml,in Purge and Trap Methanol
Synonyms
3-Chloropropionitrile|3-Chloropropanenitrile|542-76-7|3-Chloropropiononitrile|Propanenitrile, 3-chloro-|1-Chloro-2-cyanoethane|3-CHLOROPROPANONITRILE|Propionitrile, 3-chloro-|3-Chlorpropannitril|beta-Chloropropionitrile|USAF A-8798|RCRA waste number P027|
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads,FedEx DG Service
Size
Estado
Price
Qty
1ml
C141146-1ml
1

172,90US$

224,90US$
Guardar 52,00 US$ (23.12%)
Enter a quantity for the sizes you want to add.
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Why this grade

1000μg/ml,in Purge and Trap Methanol for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads,FedEx DG Service 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-Chloropropionitrile | 3-Chloropropanenitrile | 542-76-7 | 3-Chloropropiononitrile | Propanenitrile, 3-chloro- | 1-Chloro-2-cyanoethane | 3-CHLOROPROPANONITRILE | Propionitrile, 3-chloro- | 3-Chlorpropannitril | beta-Chloropropionitrile | USAF A-8798 | RCRA waste number P027 |
Especificaciones y pureza
1000μg/ml, in Purge and Trap Methanol
Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads, FedEx DG Service
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores
Pubchem Sid528758753
Sonrisas canónicasC(CCl)C#N
IUPAC Name3-chloropropanenitrile
InChIKeyGNHMRTZZNHZDDM-UHFFFAOYSA-N
INCHI1S/C3H4ClN/c4-2-1-3-5/h1-2H2
Isómeros SMILES C(CCl)C#N
Número ONU 3276
Grupo de embalaje I
Peso molecular 89.52
Reaxy-Rn 1098454
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1098454&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
SuperclassOrganic nitrogen compounds
ClaseOrganonitrogen compounds
SubclassOrganic cyanides
Intermediate Tree Nodes Not available
Direct ParentNitriles
Alternative Parents Organopnictogen compounds  Organochlorides  Hydrocarbon derivatives  Alkyl chlorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Cruzipain (33337 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Ppard Peroxisome proliferator-activated receptor delta (358 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeFechaArticulo
G2203145Certificate of AnalysisJun 14, 2022 C141146
Propiedades químicas y físicas
Índice de refracción1.44
Punto de inflamación (°C)83°C
Punto de ebullición (°C)176 °C
Peso molecular89.520 g/mol
XLogP30.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass89.0032 Da
Monoisotopic Mass89.0032 Da
Topological Polar Surface Area23.800 Ų
Heavy Atom Count5
Formal Charge0
Complexity51.200
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
Calculadoras de soluciones
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