Pyridine-3,4-dicarboxylic anhydride

C₇H₃NO₃CAS 4664-08-8149.10 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₃NO₃
Molar mass: 149.10 g/mol
Exact mass: 149.0113 Da
logP: 0.39Crippen estimate
Polar surface area: 56.3 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

4664-08-8

SMILES

C1=CN=CC2=C1C(=O)OC2=O

InChIKey

KFKMGUPDWTWQFM-UHFFFAOYSA-N

InChI

InChI=1S/C7H3NO3/c9-6-4-1-2-8-3-5(4)7(10)11-6/h1-3H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

1H,3H-Furo(3,4-c)pyridine-1,3-dione

Work with Pyridine-3,4-dicarboxylic anhydride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Phthalic anhydride85-44-954 % similar Nicotinic anhydride16837-38-052 % similar Methyl 4-aminopyridine-3-carboxylate16135-36-751 % similar Cinchomeronic acid490-11-948 % similar Naphthalenetetracarboxylic dianhydride81-30-148 % similar 3-Iodoisonicotinic acid methyl ester188677-49-847 % similar 3-Amino-isonicotinic acid methyl ester55279-30-647 % similar Methyl 3-bromoisonicotinate59786-31-147 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Furo[3,4-b]pyridine-5,7-dione699-98-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook