2-Chloropropionic acid - ≥95% , CAS No.598-78-7

CAS: 598-78-7 Cat. No.: C140796 Fórmula: C3H5ClO2 Peso molecular: 108.52 Beilstein Registry Number: 1720259 Número CE: 209-952-3
Disponível para encomenda
GRADE & PURITY ≥95%
Synonyms
FT-0612010 | NCIOpen2_009382 | STR00768 | alpha-Chloropropionic acid | alpha-chloro-propionic acid | 2-CHLOROPROPANOIC ACID | BCP11281 | DTXSID0021545 | UN2511 | HSDB 5713 | EC 209-952-3 | Propionic acid, alpha-chloro- | WLN: QVYG1 | Propionic acid, .alph
Storage
Room temperature
Shipped In
FedEx DG Service
Size
USA
Alemanha (EU)*
Price
Qty
100g
C140796-100g
1 Em stock
11,90US$
500g
C140796-500g
1 Em stock
35,90US$
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

Room temperature Ships 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
FT-0612010 | NCIOpen2_009382 | STR00768 | alpha-Chloropropionic acid | alpha-chloro-propionic acid | 2-CHLOROPROPANOIC ACID | BCP11281 | DTXSID0021545 | UN2511 | HSDB 5713 | EC 209-952-3 | Propionic acid, alpha-chloro- | WLN: QVYG1 | Propionic acid, .alph
Especificações e pureza
≥95%
Condições de armazenamento de armazenamento
Room temperature
Enviado em
FedEx DG Service
Pureza
≥95%
Nomes e identificadores
Pubchem Sid528756989
Sorrisos canónicosCC(C(=O)O)Cl
IUPAC Name2-chloropropanoic acid
InChIKeyGAWAYYRQGQZKCR-UHFFFAOYSA-N
INCHI1S/C3H5ClO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)
SMILES isoméricas CC(C(=O)O)Cl
WGK Alemanha 1
RTECS UE8575000
Número UN 2511
Grupo de embalagem III
Peso molecular 108.52
Beilstein 1720259
Reaxy-Rn 773799
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=773799&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 acids and derivatives
ClasseCarboxylic acids and derivatives
SubclassAlpha-halocarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentAlpha-halocarboxylic acids
Alternative Parents Monocarboxylic acids and derivatives  Carboxylic acids  Organochlorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl chlorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-halocarboxylic acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as alpha-halocarboxylic acids. These are carboxylic acids containing a halogen atom bonded to the alpha carbon atom.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Alvos associados (humanos)
GSTZ1 Tbio Glutathione S-transferase zeta 1 (4 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de ação
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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.

2 results found

Lot NumberCertificate TypeDataItem
J1928155Certificate of AnalysisAug 04, 2023 C140796
J1520122Certificate of AnalysisJun 08, 2023 C140796
Propriedades químicas e físicas
Índice de refração1.434-1.436
Ponto de inflamação (°F)215.6 °F
Ponto de inflamação (°C)107℃
Ponto de ebulição (°C)170-190℃
Ponto de fusão (°C)-14-12℃
Peso molecular108.520 g/mol
XLogP30.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass107.998 Da
Monoisotopic Mass107.998 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count6
Formal Charge0
Complexity61.800
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referências
1. Xue-Dan Hou, Ao-Lin Li, Kai-Peng Lin, Yuan-Yuan Wang, Zhi-Yin Kuang, Shi-Lin Cao.  (2017)  Insight into the structure-function relationships of deep eutectic solvents during rice straw pretreatment.  BIORESOURCE TECHNOLOGY,      [PMID:29049985] [10.1016/j.biortech.2017.10.019]
2. Jian Guan, Mengsen Niu, Zhangming Wang, Wujian Zhang, Zongjian Liu, Aiming Chen, Shengjie Xia, Panpan Zhang, Haodong Tang.  (2026)  Synthesis of ultrahigh molecular weight poly(vinylidene fluoride) via emulsion polymerization initiated by the combination of silver nanoparticles with trichloroacetic acid.  POLYMER,      [PMID:] [10.1016/j.polymer.2026.129607]
Calculadoras de soluções
Revisões

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