Isonicotinamide - ≥99% , CAS No.1453-82-3

CAS: 1453-82-3 Cat. No.: I106833 Molecular Weight: 122.12 Beilstein Registry Number: 2173 EC Number: 215-926-2
AVAILABLE TO ORDER
GRADE & PURITY ≥99%
Synonyms
4-(AMINOCARBONYL)PYRIDINE | A884626 | BB 0241857 | STR00561 | UNII-4H3BH6YX9Q | DTXSID3020756 | Isonicotineamide | pyridine-4-carboxamide | SCHEMBL44995 | Tox21_200230 | ISONIAZID IMPURITY B [EP IMPURITY] | Isonicotinate amide | Isonicotinic acid amide |
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
25g
I106833-25g
2

$11.90

$17.90
Save $6.00 (33.52%)
50g
I106833-50g
5

$20.90

$31.90
Save $11.00 (34.48%)
100g
I106833-100g
3

$35.90

$53.90
Save $18.00 (33.40%)
250g
I106833-250g
4

$40.90

$61.90
Save $21.00 (33.93%)
500g
I106833-500g
1

$45.90

$68.90
Save $23.00 (33.38%)
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Why this grade

≥99% 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 12 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
4-(AMINOCARBONYL)PYRIDINE | A884626 | BB 0241857 | STR00561 | UNII-4H3BH6YX9Q | DTXSID3020756 | Isonicotineamide | pyridine-4-carboxamide | SCHEMBL44995 | Tox21_200230 | ISONIAZID IMPURITY B [EP IMPURITY] | Isonicotinate amide | Isonicotinic acid amide |
Specifications & Purity
≥99%
Storage
Room temperature
Shipped In
Normal
Purity
≥99%
Names and Identifiers
Pubchem Sid488182058
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488182058
Canonical SmilesC1=CN=CC=C1C(=O)N
IUPAC Namepyridine-4-carboxamide
InChIKeyVFQXVTODMYMSMJ-UHFFFAOYSA-N
INCHI1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)
Isomeric SMILES C1=CN=CC=C1C(=O)N
WGK Germany 3
RTECS NR9500000
Molecular Weight 122.12
Beilstein 2173
Reaxy-Rn 2173
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2173&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.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPyridines and derivatives
SubclassPyridinecarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentPyridinecarboxamides
Alternative Parents Heteroaromatic compounds  Primary carboxylic acid amides  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Pyridinecarboxamide - Heteroaromatic compound - Primary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyridinecarboxamides. These are compounds containing a pyridine ring bearing a carboxamide.
External Descriptors pyridinecarboxamide
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
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.

21 results found

Lot NumberCertificate TypeDateItem
G2227915Certificate of AnalysisMay 19, 2026 I106833
G2227919Certificate of AnalysisMay 19, 2026 I106833
G2227921Certificate of AnalysisMay 19, 2026 I106833
H2106080Certificate of AnalysisMay 12, 2025 I106833
H2106081Certificate of AnalysisMay 12, 2025 I106833
H2106083Certificate of AnalysisMay 12, 2025 I106833
J2514523Certificate of AnalysisJun 13, 2024 I106833
J2514514Certificate of AnalysisJun 13, 2024 I106833
I2426224Certificate of AnalysisJun 13, 2024 I106833
I2426156Certificate of AnalysisJun 13, 2024 I106833
G1903058Certificate of AnalysisApr 17, 2023 I106833
L2208079Certificate of AnalysisSep 12, 2022 I106833
L2208080Certificate of AnalysisSep 12, 2022 I106833
L2208081Certificate of AnalysisSep 12, 2022 I106833
L2208082Certificate of AnalysisSep 12, 2022 I106833
L2208083Certificate of AnalysisSep 12, 2022 I106833
L2208499Certificate of AnalysisSep 12, 2022 I106833
L2208633Certificate of AnalysisSep 12, 2022 I106833
L2208634Certificate of AnalysisSep 12, 2022 I106833
G2227920Certificate of AnalysisJul 07, 2022 I106833
G2227918Certificate of AnalysisJul 07, 2022 I106833

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Chemical and Physical Properties
SolubilitySoluble in dioxane (10 mg/ml), methanol, water (191.7 mg/ml at 37 °C), ethanol, and DMSO.
Melt Point(°C)155-158°C
Molecular Weight122.120 g/mol
XLogP3-0.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass122.048 Da
Monoisotopic Mass122.048 Da
Topological Polar Surface Area56.000 Ų
Heavy Atom Count9
Formal Charge0
Complexity108.000
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
Citations of This Product
References
1. Yangyang Sun, Zhuzhu Tang, Yanjun Li, Yongkang Song, Hualei Wang, Dongzhi Wei, Shengli Yang.  (2023)  Identification and evolution of non-traditional nitrilase from Spirosoma linguale DSM 74 with high hydration activity.  BIOORGANIC CHEMISTRY,      [PMID:38185008] [10.1016/j.bioorg.2023.107055]
2. Bingqing Zhu, Mengyuan Xia, Zhenfeng Ding, Xiaoyi Rong, Xuefeng Mei.  (2023)  Enhancing physical and chemical stability of hygroscopic hydroxytyrosol by cocrystal formation.  INTERNATIONAL JOURNAL OF PHARMACEUTICS,      [PMID:37793465] [10.1016/j.ijpharm.2023.123470]
3. Junling Guo, Zhongyi Cheng, Lukasz Peplowski, Zhemin Zhou.  (2023)  Highly efficient biosynthesis of isonicotinamide through a substrate access tunnel engineered nitrile hydratase from Carbonactinospora thermoautotrophicus.  NEW JOURNAL OF CHEMISTRY,  47  (28): (13279-13285).  [PMID:] [10.1039/D3NJ00331K]
4. Zhiyong Zheng, Yuehua Deng, Weining Xie, Sirui Chen, Xiaoxiao Liang, Shiyuan Liu, Yanbin Jiang, Huaiyu Yang.  (2023)  Co-Former Screening Method for Multicomponent Crystals Based on Partial Least Squares Regression: A Case Study of Ciprofloxacin.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/acs.cgd.2c01414]
5. Chun-Yan Zhang, Wei-Yi Zhang, Guo-Ying Chen, Tong-Qing Chai, Hao Zhang, Yi Xu, Feng-Qing Yang.  (2022)  Vitamin B3 as a high acid-alkali tolerant peroxidase mimic for colorimetric detection of hydrogen peroxide and glutathione.  Arabian Journal of Chemistry,      [PMID:] [10.1016/j.arabjc.2022.103823]
6. Qiaoling Liu, Hongyu Mou, Wenjun Chen, Xinhui Zhao, Haitao Yu, Zhimin Xue, Tiancheng Mu.  (2019)  Highly Efficient Dissolution of Lignin by Eutectic Molecular Liquids.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.9b05059]
7. Zhen Li, Meiqi Li, Bo Peng, Bingqing Zhu, Jian-rong Wang, Xuefeng Mei.  (2019)  Improving Compliance and Decreasing Drug Accumulation of Diethylstilbestrol through Cocrystallization.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/acs.cgd.8b01911]
8. Shuzhen Ren, Mingyu Liu, Chao Hong, Guowen Li, Jiabin Sun, Jianying Wang, Lei Zhang, Yan Xie.  (2018)  The effects of pH, surfactant, ion concentration, coformer, and molecular arrangement on the solubility behavior of myricetin cocrystals.  Acta Pharmaceutica Sinica B,      [PMID:30766778] [10.1016/j.apsb.2018.09.008]
9. Yanlei Kang, Jianming Gu, Xiurong Hu.  (2016)  Syntheses, structure characterization and dissolution of two novel cocrystals of febuxostat.  JOURNAL OF MOLECULAR STRUCTURE,      [PMID:] [10.1016/j.molstruc.2016.10.044]
10. Hongli Sun, Yiwei Wu.  (2013)  Field-amplified sample injection for the determination of isonicotinamide and nicotinamide in whitening cosmetics and supplemented foodstuffs by MEKC.  Analytical Methods,  (20): (5615-5621).  [PMID:] [10.1039/C3AY40914G]
11. Zhanghao Wu, Yue Zhao, Changlei Wang, Tianshu Ma, Chen Chen, Yuhui Liu, Tianci Jia, Yuhang Zhai, Cong Chen, Cheng Zhang, Guogyang Cao, Zhenhai Yang, Dewei Zhao, Xiaofeng Li.  (2025)  Enhancing Photovoltaically Preferred Orientation in Wide-Bandgap Perovskite for Efficient All-Perovskite Tandem Solar Cells.  ADVANCED MATERIALS,      [PMID:39763405] [10.1002/adma.202412943]
12. Guiyu Chen, Pengpeng Yang, Mengyang Cai, Keke Zhang.  (2025)  The Confinement Crystallization Behavior of Isonicotinamide within Functionalized Pores: Correlation between Polymorph Selection and Surface Chemistry.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/acs.cgd.5c00983]
Solution Calculators
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