chempirical

Dicyclohexyl-3,4,3',4'-tetracarboxylic dianhydride

C16H18O6CAS 122640-83-9306.31 g/mol

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Acid anhydride

Properties

Molecular formula
C16H18O6
Molar mass
306.31 g/mol
Exact mass
306.1103 Da
logP
1.22Crippen estimate
Polar surface area
86.7 Ų
H-bond donors / acceptors
0 / 6
Rotatable bonds
1

Identifiers

CAS number
122640-83-9
SMILES
C1CC2C(CC1C3CCC4C(C3)C(=O)OC4=O)C(=O)OC2=O
InChIKey
SNHKMHUMILUWSJ-UHFFFAOYSA-N
InChI
InChI=1S/C16H18O6/c17-13-9-3-1-7(5-11(9)15(19)21-13)8-2-4-10-12(6-8)16(20)22-14(10)18/h7-12H,1-6H2

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Work with Dicyclohexyl-3,4,3',4'-tetracarboxylic dianhydride

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

3-Oxabicyclo[3.2.0]heptane-2,4-dione4462-96-871 % similar Rikacid mh19438-60-961 % similar cis-1,2-Cyclohexanedicarboxylic anhydride13149-00-358 % similar Rel-(3ar,6as)-tetrahydro-1H-cyclopenta[C]furan-1,3(3ah)-dione35878-28-558 % similar Hexahydrophthalic anhydride85-42-758 % similar Tetrahydro-1H-cyclopenta[1,2-C:3,4-C′]difuran-1,3,4,6(3ah)-tetrone6053-68-550 % similar 1,2,3,6-Tetrahydrophthalic anhydride85-43-844 % similar Tetrahydrophthalic anhydride935-79-544 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Naphthalenyl β-D-galactopyranoside33993-25-8 Cimifugin37921-38-3

Elsewhere

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