3A,4,7,7A-Tetrahydro-2-hydroxy-4,7-methano-1H-isoindole-1,3(2H)-dione

C₉H₉NO₃CAS 21715-90-2179.17 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₉NO₃
Molar mass: 179.17 g/mol
Exact mass: 179.0582 Da
Melting point: 164 °C
logP: 0.18Crippen estimate
Polar surface area: 57.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Identifiers

CAS number

21715-90-2

SMILES

O=C1C2C3C=CC(C3)C2C(=O)N1O

InChIKey

ZUSSTQCWRDLYJA-UHFFFAOYSA-N

InChI

InChI=1S/C9H9NO3/c11-8-6-4-1-2-5(3-4)7(6)9(12)10(8)13/h1-2,4-7,13H,3H2

Weigh it out

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

Names and synonyms

8 names

4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-hydroxy-
5-Norbornene-2,3-dicarboximide, N-hydroxy-
N-Hydroxy-5-norbornene-2,3-dicarboximide
N-Hydroxy-5-bicyclo[2.2.1]heptene-2,3-dicarboximide
NSC 100740
NSC 12953
HONB
3,5-Dioxo-4-azatricyclo[5.2.1.02′6]dec-8-en-4-ol

Work with 3A,4,7,7A-Tetrahydro-2-hydroxy-4,7-methano-1H-isoindole-1,3(2H)-dione

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

Same formula

N-1,3-Benzodioxol-5-ylacetamide13067-19-1 3-(4-Nitrophenyl)-2-propen-1-ol1504-63-8 1-(3-Nitrophenyl)-1-propanone17408-16-1 1-(6-Amino-1,3-benzodioxol-5-yl)ethanone28657-75-2 1-Methoxy-4-(2-nitroethenyl)benzene3179-10-0 2-Methoxy-β-nitrostyrene3316-24-3 5-Acetyl-2-hydroxybenzamide40187-51-7 Hippuric acid495-69-2

Elsewhere

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