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Reference substances

Reference substances

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General information

Inventory

EC number:
200-441-0
EC name:
Nicotinic acid
CAS number:
59-67-6

No inventory information available

Reference substance information

IUPAC name:
pyridine-3-carboxylic acid
Synonyms
Names:
3-Pyridinecarboxylic acid
NS
Niacin
Nicotinic acid
Identifier:
CAS number
59-67-6
Identifier:
IUPAC name
pyridine-3-carboxylic acid
Identifier:
other: InChl
InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
Identifier:
other: SMILES notation
c1cc(cnc1)C(=O)O
Nicotinic acid

CAS information

CAS number:
59-67-6

Molecular and structural information

Molecular formula:
C6H5NO2
Molecular weight:
123.109
SMILES notation:
OC(=O)c1cccnc1
InChl:
InChI=1/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
Structural formula:
Chemical structure