Acetic acid-1-13C - ≥98% , CAS No.1563-79-7

CAS: 1563-79-7 Cat. No.: A579677 Molecular Weight: 61.04 Beilstein Registry Number: 1699490 EC Number: 625-762-7
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
Acetic acid-1-13C|1563-79-7|Acetic-1-13c acid|Acetic acid C-13|(1-13C)Acetic acid|UNII-29JB6BU01H|29JB6BU01H|ACETIC ACID-1-13C-D4|63459-47-2|Acetic acid (1-13C)|MFCD00037366|AKOS015894017|Acetic acid-1-13C, 99 atom % 13C|J-009297|Q27254426
Storage
Room temperature,Argon charged
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
50mg
A579677-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$60.90
250mg
A579677-250mg
1
$232.90
1g
A579677-1g
1
$799.90
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Room temperature,Argon charged Ships Normal 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

Synonyms
Acetic acid-1-13C | 1563-79-7 | Acetic-1-13c acid | Acetic acid C-13 | (1-13C)Acetic acid | UNII-29JB6BU01H | 29JB6BU01H | ACETIC ACID-1-13C-D4 | 63459-47-2 | Acetic acid (1-13C) | MFCD00037366 | AKOS015894017 | Acetic acid-1-13C, 99 atom % 13C | J-009297 | Q27254426
Specifications & Purity
≥98%
Storage
Room temperature, Argon charged
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid504765286
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504765286
Canonical SmilesCC(=O)O
IUPAC Nameacetic acid
InChIKeyQTBSBXVTEAMEQO-VQEHIDDOSA-N
INCHI1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/i2+1
Isomeric SMILES C[13C](=O)O
WGK Germany 3
Molecular Weight 61.04
Beilstein 1699490
Reaxy-Rn 506007
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506007&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
ClassCarboxylic acids and derivatives
SubclassCarboxylic acids
Intermediate Tree Nodes Not available
Direct ParentCarboxylic acids
Alternative Parents Monocarboxylic acids and derivatives  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
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
A2429304Certificate of AnalysisJan 11, 2024 A579677
A2429305Certificate of AnalysisJan 11, 2024 A579677
A2429307Certificate of AnalysisJan 11, 2024 A579677
A2429308Certificate of AnalysisJan 11, 2024 A579677
E23181182Certificate of AnalysisMay 25, 2023 A579677
E23181201Certificate of AnalysisMay 25, 2023 A579677
Chemical and Physical Properties
SensitivityMoisture sensitive
Refractive Indexn20/D 1.372
Flash Point(°F)104 °F
Flash Point(°C)40 °C
Boil Point(°C)117-118 °C
Melt Point(°C)16.2 °C
Molecular Weight61.045 g/mol
XLogP3-0.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass61.0245 Da
Monoisotopic Mass61.0245 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count4
Formal Charge0
Complexity31.000
Isotope Atom Count1
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
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