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3-Cyanopyridine

CAS 100-54-9C6H4N2MW 104.11

3-Cyanopyridine (CAS 100-54-9) — formula C6H4N2, molecular weight 104.11; category organic chemicals.

Product Overview

CAS Number100-54-9
Molecular FormulaC6H4N2
Molecular Weight104.11
Melting Point51 °C
Boiling Point206.9 °C
LogPlog Kow = 0.36
ApplicationsUses: Used for organic synthesis, [HSDB], Org synthesis, CHEM INT, EG, FOR NICOTINYL ALCOHOL & NIACINAMIDE, Methods of Manufacturing: VAPOR PHASE AMMOXIDATION OF 3-METHYLPYRIDINE WITH AMMONIA IN THE PRESENCE OF AIR, U.S. Production: 2023: <75, 000 lb, 2022: <75, 2021: 75, 000 - <500, 2020: 500, 000 - <1, 000, (1980) PROBABLY GREATER THAN 2.27X10+6 GRAMS, General Manufacturing Information: 3-Pyridinecarbonitrile: ACTIVE
CategoryOrganic Chemicals

Applications

Documented applications: Uses: Used for organic synthesis, [HSDB], Org synthesis, CHEM INT, EG, FOR NICOTINYL ALCOHOL & NIACINAMIDE, Methods of Manufacturing: VAPOR PHASE AMMOXIDATION OF 3-METHYLPYRIDINE WITH AMMONIA IN THE PRESENCE OF AIR, U.S. Production: 2023: <75, 000 lb, 2022: <75, 2021: 75, 000 - <500, 2020: 500, 000 - <1, 000, (1980) PROBABLY GREATER THAN 2.27X10+6 GRAMS, General Manufacturing Information: 3-Pyridinecarbonitrile: ACTIVE.

Technical Profile

What this product is

3-Cyanopyridine is a carbon-based organic compound with CAS registry number 100-54-9 and molecular formula C6H4N2 (molecular weight 104.11), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 100-54-9

Its molecular formula C6H4N2 comprises 6 C, 4 H, 2 N atoms.

Also known as: 3-Cyanopyridine · 3-氰基吡啶

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3-Cyanopyridine?

The CAS registry number of 3-Cyanopyridine is 100-54-9.

What is the molecular formula and molecular weight of 3-Cyanopyridine?

Molecular formula C6H4N2, molecular weight 104.11.

What other names is 3-Cyanopyridine known by?

It is also registered under: 3-Cyanopyridine, 3-氰基吡啶.

What are the documented applications of 3-Cyanopyridine?

Recorded applications: Uses: Used for organic synthesis, [HSDB], Org synthesis, CHEM INT, EG, FOR NICOTINYL ALCOHOL & NIACINAMIDE, Methods of Manufacturing: VAPOR PHASE AMMOXIDATION OF 3-METHYLPYRIDINE WITH AMMONIA IN THE PRESENCE OF AIR, U.S. Production: 2023: <75, 000 lb, 2022: <75, 2021: 75, 000 - <500, 2020: 500, 000 - <1, 000, (1980) PROBABLY GREATER THAN 2.27X10+6 GRAMS, General Manufacturing Information: 3-Pyridinecarbonitrile: ACTIVE.

Which category does 3-Cyanopyridine belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3-Cyanopyridine (CAS 100-54-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number100-54-9
PubChem CID79
Molecular formulaC6H4N2
IUPAC namepyridine-3-carbonitrile
UNII (FDA)X64V0K6260

Computed descriptors

Molecular Weight104.11
XLogP30.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass104.037448136
Monoisotopic Mass104.037448136
Topological Polar Surface Area36.7
Heavy Atom Count8

Physicochemical values on record

Boiling Point206.9 °C
Melting Point51 °C
Flash Point87 °C
SolubilityIn water, 1.35X10+5 mg/l @ 20 °C
Density1.1590 @ 25 °C
Vapor Pressure0.29 [mmHg]
Vapor Pressure0.296 mm Hg @ 25 °C
LogPlog Kow = 0.36
LogP0.36

Documented uses on record

    Used for organic synthesis; [HSDB]CHEM INT, EG, FOR NICOTINYL ALCOHOL & NIACINAMIDE

    Synonyms and trade names

    3-cyanopyridine; Nicotinonitrile; 100-54-9; 3-PYRIDINECARBONITRILE; Nicotinic acid nitrile; 3-Pyridinenitrile; 3-Pyridylcarbonitrile; 3-Azabenzonitrile; Nitryl kwasu nikotynowego; DTXSID1026665; 3-Pyridinecarboxylic acid, nitrile; NSC-17558; CHEBI:86556; X64V0K6260; DTXCID606665; RefChem:505106

    GHS hazard classification

    Reported hazard statementsH302 (100%), H315 (60%), H318 (42.4%), H319 (57.6%), H335 (54.1%), H371, H373

    H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

    H315 (60%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    3-Cyanopyridine · CAS 100-54-9 · C6H4N2. UNII X64V0K6260. Boiling Point: 206.9 °C; Melting Point: 51 °C; Flash Point: 87 °C.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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