3'-Chloroacetanilide - ≥98%(GC) , CAS No.588-07-8

CAS: 588-07-8 Cat. No.: C153718 Molecular Weight: 169.61 Beilstein Registry Number: 12(2)321 EC Number: 209-610-3
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GRADE & PURITY ≥98%(GC)
Synonyms
3'-Chloroacetanilide | 3-Chloroacetanilide | EF-0227 | NSC6116 | NSC-6116 | NSC 39967 | Acetanilide, 3'-chloro- | AQ-012/40326599 | HSDB 1409 | NSC39967 | NSC-39967 | BRN 2208105 | SCHEMBL357999 | EINECS 209-610-3 | FT-0615446 | MFCD00016341 | N-(3-Chloro
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
C153718-5g
6
$11.90
25g
C153718-25g
4
$35.90
100g
C153718-100g
3
$126.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
3'-Chloroacetanilide | 3-Chloroacetanilide | EF-0227 | NSC6116 | NSC-6116 | NSC 39967 | Acetanilide, 3'-chloro- | AQ-012/40326599 | HSDB 1409 | NSC39967 | NSC-39967 | BRN 2208105 | SCHEMBL357999 | EINECS 209-610-3 | FT-0615446 | MFCD00016341 | N-(3-Chloro
Specifications & Purity
≥98%(GC)
Storage
Room temperature
Shipped In
Normal
Purity
≥98%(GC)
Names and Identifiers
Pubchem Sid488181360
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181360
Canonical SmilesCC(=O)NC1=CC(=CC=C1)Cl
IUPAC NameN-(3-chlorophenyl)acetamide
InChIKeyMUUQHCOAOLLHIL-UHFFFAOYSA-N
INCHI1S/C8H8ClNO/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5H,1H3,(H,10,11)
Isomeric SMILES CC(=O)NC1=CC(=CC=C1)Cl
RTECS AE1000100
Molecular Weight 169.61
Beilstein 12(2)321
Reaxy-Rn 2208105
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2208105&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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassAnilides
Intermediate Tree Nodes Acetanilides - Haloacetanilides
Direct ParentM-haloacetanilides
Alternative Parents N-acetylarylamines  Chlorobenzenes  Aryl chlorides  Acetamides  Secondary carboxylic acid amides  Organopnictogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents M-haloacetanilide - N-acetylarylamine - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as m-haloacetanilides. These are organic compounds containing an acetamide group conjugated to a phenyl group, which is in turn meta-substituted with a halogen atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
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.

6 results found

Lot NumberCertificate TypeDateItem
D2326499Certificate of AnalysisApr 01, 2023 C153718
D2326500Certificate of AnalysisApr 01, 2023 C153718
D2326501Certificate of AnalysisApr 01, 2023 C153718
D2326502Certificate of AnalysisApr 01, 2023 C153718
D2326506Certificate of AnalysisApr 01, 2023 C153718
D2326509Certificate of AnalysisApr 01, 2023 C153718
Chemical and Physical Properties
Boil Point(°C)172°C/0.8mmHg(lit.)
Melt Point(°C)76 °C
Molecular Weight169.610 g/mol
XLogP32.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass169.029 Da
Monoisotopic Mass169.029 Da
Topological Polar Surface Area29.100 Ų
Heavy Atom Count11
Formal Charge0
Complexity149.000
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
Solution Calculators
Reviews

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