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

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

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

Weigh it out

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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 3-Oxabicyclo(3.1.0)hexane-2,4-dione5617-74-364 % similar Rikacid MH19438-60-961 % similar cis-1,2-Cyclohexanedicarboxylic anhydride13149-00-358 % similar (-)-trans-1,2-Cyclohexanedicarboxylic anhydride31982-85-158 % similar Rel-(3aR,6aS)-Tetrahydro-1H-cyclopenta[c]furan-1,3(3aH)-dione35878-28-558 % similar trans-Cyclohexane-1,2-dicarboxylic anhydride71749-03-658 % similar Hexahydrophthalic anhydride85-42-758 % 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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