Isonicotinamide

Modify Date: 2026-07-02 11:48:35

Isonicotinamide Structure
Isonicotinamide structure
Common Name Isonicotinamide
CAS Number 1453-82-3 Molecular Weight 122.13
Density 1.2±0.1 g/cm3 Boiling Point 334.4±15.0 °C at 760 mmHg
Molecular Formula C6H6N2O Melting Point 155-157 °C(lit.)
MSDS Chinese USA Flash Point 156.0±20.4 °C
Symbol GHS07
GHS07
Signal Word Warning

 Use of Isonicotinamide


Isonicotinamide is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name isonicotinamide
Synonym More Synonyms

 Isonicotinamide Biological Activity

This table contains bioactivity, target information and biological‑assay experimental data of this compound.

Description Isonicotinamide is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.2±0.1 g/cm3
Boiling Point 334.4±15.0 °C at 760 mmHg
Melting Point 155-157 °C(lit.)
Molecular Formula C6H6N2O
Molecular Weight 122.13
Flash Point 156.0±20.4 °C
Exact Mass 122.048012
PSA 55.98000
LogP -0.28
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.570
InChIKey VFQXVTODMYMSMJ-UHFFFAOYSA-N
SMILES NC(=O)c1ccncc1
Water Solubility 191.7 g/L (37 ºC)

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

 Toxicological Information

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NR9500000
CHEMICAL NAME :
Isonicotinamide
CAS REGISTRY NUMBER :
1453-82-3
BEILSTEIN REFERENCE NO. :
0002173
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C6-H6-N2-O
MOLECULAR WEIGHT :
122.14
WISWESSER LINE NOTATION :
T6NJ DVZ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
DNA inhibition
TEST SYSTEM :
Rodent - rat Liver
DOSE/DURATION :
20 mmol/L
REFERENCE :
JJIND8 JNCI, Journal of the National Cancer Institute. (Washington, DC) V.61-79, 1978-87. For publisher information, see JNCIEQ. Volume(issue)/page/year: 69,1353,1982

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi:Irritant
Risk Phrases R36/37/38
Safety Phrases S26-S36
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS NR9500000
HS Code 29333999

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Articles29

More Articles

This table lists relevant public references with title, journal and publication metadata for this compound.

Targeting SRPK1 to control VEGF-mediated tumour angiogenesis in metastatic melanoma.

Br. J. Cancer 111(3) , 477-85, (2014)

Current therapies for metastatic melanoma are targeted either at cancer mutations driving growth (e.g., vemurafenib) or immune-based therapies (e.g., ipilimumab). Tumour progression also requires angi...

[Fe(CN)5(isoniazid)](3-): an iron isoniazid complex with redox behavior implicated in tuberculosis therapy.

J. Inorg. Biochem. 140 , 236-44, (2014)

Tuberculosis has re-emerged as a worldwide threat, which has motivated the development of new drugs. The antituberculosis complex Na3[Fe(CN)5(isoniazid)] (IQG607) in particular is of interest on accou...

Measuring induction times and crystal nucleation rates.

Faraday Discuss. 179 , 199-214, (2015)

A large variation is observed in induction times measured under equal conditions in 1 ml solutions. Ruling out experimental errors, this variation originates from the nucleation process. The induction...

 IsonicotinamideBioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

4-Pyridine carboxamide
MFCD00006432
4-pyridinecarboximidic acid
4-Pyridinecarboxamide
EINECS 215-926-2
4-(HYDROXYIMINOMETHYL)PYRIDINE
Isonicotinamide
Pyridine-4-carboximidic acid
pyridine-4-carboxamide

 Isonicotinamide | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the SMILES notation of isonicotinamide?
A: SMILES notation of isonicotinamide is NC(=O)c1ccncc1.
Q: What English synonyms does isonicotinamide have?
A: English synonyms of isonicotinamide: 4-Pyridine carboxamide, MFCD00006432, 4-pyridinecarboximidic acid, 4-Pyridinecarboxamide, EINECS 215-926-2, 4-(HYDROXYIMINOMETHYL)PYRIDINE, Isonicotinamide, Pyridine-4-carboximidic acid, pyridine-4-carboxamide.
Q: What are the uses of isonicotinamide?
A: Main uses of isonicotinamide: Isonicotinamide is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Q: What is the English name of isonicotinamide?
A: The English name of isonicotinamide is isonicotinamide.
Q: What is the LogP of isonicotinamide?
A: LogP of isonicotinamide is -0.28.
Q: What is the molecular formula of isonicotinamide?
A: Molecular formula of isonicotinamide is C6H6N2O.
Q: What is the InChIKey of isonicotinamide?
A: InChIKey of isonicotinamide is VFQXVTODMYMSMJ-UHFFFAOYSA-N.
Q: What is the molecular weight of isonicotinamide?
A: Molecular weight of isonicotinamide is 122.13.
Q: What are the upstream materials of isonicotinamide?
A: Related upstream materials(CAS) of isonicotinamide: 100-48-1;3731-53-1;14906-59-3;144223-31-4;696-54-8;38557-82-3;586-95-8;100-43-6;2196-13-6;55-22-1.
Q: How is the water solubility of isonicotinamide?
A: Water solubility of isonicotinamide: 191.7 g/L (37 ºC).

 Isonicotinamidefactory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd
Dayang Chem (Hangzhou) Co., Ltd.
Henan Tianfu Chemical Co., Ltd.
Zhongshan Xingrui Chemical Co. , Ltd.
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