1-Hydroxybutan-2-one - ≥95% , CAS No.5077-67-8

CAS: 5077-67-8 Cat. No.: H193640 Summenformel: C4H8O2 Molekulargewicht: 88.11 EG-Nummer: 225-790-6
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GRADE & PURITY ≥95%
Synonyms
HY-W005327 | SY012223 | STL556954 | NSC-202167 | M57N50D82D | 1-hydroxy-butan-2-one | 1-Hydroxybutan-2-one | FEMA No. 3173 | DTXSID1063693 | DTXSID5037072 | CHEBI:88390 | Q27160237 | PD164974 | UNII-M57N50D82D | A852053 | FT-0607921 | AS-57317 | EINECS 22
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
250mg
H193640-250mg
Auf Bestellung · 8–12 Wochen
35,49€
1g
H193640-1g
—
1 Auf Lager
71,07€
5g
H193640-5g
—
3 Auf Lager
221,19€
10g
H193640-10g
—
3 Auf Lager
416,43€
25g
H193640-25g
—
2 Auf Lager
708,86€
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 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 7 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
HY-W005327 | SY012223 | STL556954 | NSC-202167 | M57N50D82D | 1-hydroxy-butan-2-one | 1-Hydroxybutan-2-one | FEMA No. 3173 | DTXSID1063693 | DTXSID5037072 | CHEBI:88390 | Q27160237 | PD164974 | UNII-M57N50D82D | A852053 | FT-0607921 | AS-57317 | EINECS 22
Spezifikationen & Reinheit
≥95%
Storage
Room temperature
Verschickt in
Normal
Aktionsart
INHIBITOR
Reinheit
≥95%
Namen und Kennungen
Pubchem Sid504759098
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504759098
Kanonisches LächelnCCC(=O)CO
IUPAC Name1-hydroxybutan-2-one
InChIKeyGFAZHVHNLUBROE-UHFFFAOYSA-N
INCHI1S/C4H8O2/c1-2-4(6)3-5/h5H,2-3H2,1H3
Isomere SMILES CCC(=O)CO
Molekulargewicht 88.11
Reaxy-Rn 506105
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506105&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 oxygen compounds
KlasseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones
Direct ParentAlpha-hydroxy ketones
Alternative Parents Primary alcohols  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-hydroxy ketone - Organic oxide - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as alpha-hydroxy ketones. These are organic compounds containing a carboxylic acid, and an amine group attached to the alpha carbon atom, relative to the C=O group.
External Descriptors a small molecule
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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.

8 results found

Lot NumberCertificate TypeDatumArtikel
G2613043Certificate of AnalysisJul 21, 2026 H193640
L2206394Certificate of AnalysisSep 13, 2024 H193640
L2206396Certificate of AnalysisSep 13, 2024 H193640
L2206412Certificate of AnalysisSep 13, 2024 H193640
L2206413Certificate of AnalysisSep 13, 2024 H193640
L2206414Certificate of AnalysisSep 13, 2024 H193640
C1920008Certificate of AnalysisAug 06, 2024 H193640
H2209475Certificate of AnalysisMay 08, 2024 H193640
Chemische und physikalische Eigenschaften
Molekulargewicht88.110 g/mol
XLogP3-0.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass88.0524 Da
Monoisotopic Mass88.0524 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count6
Formal Charge0
Complexity49.500
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
FAQs und Artikel
Citations of This Product
Referenzen
1. Lina Qiao, Jing Wang, Bing Liu, Junyi Wang, Ruifang Wang, Ning Zhang, Baoguo Sun, Yuping Liu, Shuqi Wang, Jie Sun.  (2023)  Dynamic variation and interrelation in the volatile and non-volatile fractions of deep-fried green onion (Allium fistulosum L.) oil with different frying temperatures.  JOURNAL OF FOOD COMPOSITION AND ANALYSIS,      [PMID:] [10.1016/j.jfca.2023.105739]
2. Lanting Li, Yuhong Zhang, Zhenlei Peng, Chuan Wang.  (2020)  Study of organic impurities affecting ultraviolet transmittance in monoethylene glycol and their formation mechanism.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2020.105635]
3. Haiyong Wang, Haosheng Xin, Chiliu Cai, Changhui Zhu, Zhongxun Xiu, Qiying Liu, Yujing Weng, Chenguang Wang, Xinghua Zhang, Shijun Liu, Zifang Peng, Longlong Ma.  (2020)  Selective C3-C4 Keto-Alcohol Production from Cellulose Hydrogenolysis over Ni-WOx/C Catalysts.  ACS Catalysis,      [PMID:] [10.1021/acscatal.0c02375]
4. Zelong Mei, Kun Zhang, Ge Qu, Jun-Kuan Li, Baoyan Liu, Jun-An Ma, Ran Tu, Zhoutong Sun.  (2020)  High-Throughput Fluorescence Assay for Ketone Detection and Its Applications in Enzyme Mining and Protein Engineering.  ACS Omega,      [PMID:32566823] [10.1021/acsomega.0c00245]
5. Wu Hua-Lei, Zhang Jian-Dong, Zhang Chao-Feng, Fan Xiao-Jun, Chang Hong-Hong, Wei Wen-Long.  (2016)  Characterization of Four New Distinct ω-Transaminases from Pseudomonas putida NBRC 14164 for Kinetic Resolution of Racemic Amines and Amino Alcohols.  APPLIED BIOCHEMISTRY AND BIOTECHNOLOGY,  181  (3): (972-985).  [PMID:27714638] [10.1007/s12010-016-2263-9]
6. Xiaohao Liu, Zibin Xia, Rui Diao, Fenglei Qi, Ying Zhang, Peiyong Ma.  (2024)  Rice husk-based biogenic silica-anchored Sn-Co bimetallic catalysts for cellulose hydrogenolysis: Structural regulation and mechanism study.  Molecular Catalysis,      [PMID:] [10.1016/j.mcat.2024.113861]
7. Tong Zhang, Haiyong Wang, Chenguang Wang, Qiying Liu.  (2025)  Catalytic hydrogenolysis of fructose to acetol over Ni/CeO2 catalysts.  INDUSTRIAL CROPS AND PRODUCTS,      [PMID:] [10.1016/j.indcrop.2025.122213]
Lösungsrechner
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What are the CAS number, molecular formula and molecular weight?
The CAS Number is 5077-67-8, the molecular formula is C4H8O2, and the molecular weight is 88.11 g/mol. InChIKey GFAZHVHNLUBROE-UHFFFAOYSA-N.

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