PICOLINIC-D4 ACID

1. Names and Identifiers

1.2 Synonyms: [2H4]-Picolinic acid; 2-Picolinic-d4 Acid; 2-Pyridine-d4-carboxylic acid;

2. MSDS

Acute toxicity - Oral, Category 4

Eye irritation, Category 2

Pictogram(s)
Signal word	Warning
Hazard statement(s)	H302 Harmful if swallowed H319 Causes serious eye irritation
Precautionary statement(s)
Prevention	P264 Wash ... thoroughly after handling. P270 Do not eat, drink or smoke when using this product. P280 Wear protective gloves/protective clothing/eye protection/face protection.
Response	P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/…if you feel unwell. P330 Rinse mouth. P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. P337+P313 If eye irritation persists: Get medical advice/attention.
Storage	none
Disposal	P501 Dispose of contents/container to ...

none

3. Computed Properties

Molecular Weight：127.13g/mol
Molecular Formula：C₆H₅NO₂
Compound Is Canonicalized：True
XLogP3-AA：127.057135386
Monoisotopic Mass：127.057135386
Complexity：114
Rotatable Bond Count：1
Hydrogen Bond Donor Count：1
Hydrogen Bond Acceptor Count：3
Topological Polar Surface Area：50.2
Heavy Atom Count：：9
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：0
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：4
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADcYBiMAAAAAAAAAAAAAAAAAAAAAAAAAAsAAAAAAAAAAABgAAAHgAACAAACAjBlgQ8iJIIEgCoATT3TASCgCA3AiAI2CG4bNgKJvLAlbGEcQhkwAHY2YeYSAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==