Isonicotinic acid | CAS No. 55-22-1

Isonicotinic acid

Basic Information

CAS Number

55-22-1

Molecular Formula

C6H5NO2

Molecular Weight

123.11 g/mol

AD

Basic Physical Properties

Melting Point

≥300?°C

Boiling Point

260 °C (15 mmHg)

Water Solubility

5.2 g/L (20 oC)

Flash Point

260°C/15mm

Solubility

6g/l

Refractive Index

1.5423 (estimate)

Vapor Pressure

5.56E-07mmHg at 25°C

C1=CN=CC=C1C(=O)O

InChI

InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)

InChIKey

TWBYWOBDOCUKOW-UHFFFAOYSA-N

LogP

0.7797999999999999

pKa

4.96(at 25℃)

Topological Polar Surface Area

50.19 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

108

Safety Information

View Safety Information

GHS Hazard Pictograms

H315H315
H319H319
H335H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • AKOS000118918
  • gamma-Pyridinecarboxylic acid
  • MN1
  • NSC1483
  • W-105578
  • isonicotinicacid
  • 4-Picolinic acid
  • Biomol-NT_000289
  • AM81318
  • Y8SYN761TQ
  • 4-Carboxypyridine
  • LS-7134
  • isonicotonic acid
  • NSC-1483
  • STR00113
  • Isonicotinic acid, purum, >=99.0% (T)
  • 1,4-Dihydroisonicotinic acid
  • CHEMBL1203
  • BS-3754
  • AC-907/25014347
  • EINECS 200-228-2
  • Nicotinic Acid Imp. E (Pharmeuropa): Pyridine-4-carboxylic A
  • FT-0627428
  • I0207
  • CAS-55-22-1
  • Tox21_200502
  • Pyridinecarboxylic acid-(4)
  • AC8088
  • MFCD00006429
  • S3V
  • isonicotinsyre-

MDL Number

MFCD00006429

Customs Code

2933399090

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