| CAS Number | 4750-17-8 |
| Catalog Number | AG01C7NL(AGN-PC-000Y94) |
| Chemical Name | 1,3-Cyclopentanedicarboxaldehyde |
| IUPAC Name | cyclopentane-1,3-dicarbaldehyde |
| InChI | InChI=1S/C7H10O2/c8-4-6-1-2-7(3-6)5-9/h4-7H,1-3H2 |
| InChI Key | JWWOLXQVNVCQSJ-UHFFFAOYSA-N |
| MDL Number | MFCD24673876 |
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.1531 |
| SMILES | C1(CC(CC1)C=O)C=O |
| Synonyms | Cyclopentane-1,3-dicarbaldehyde,
1,3-Cyclopentanedicarboxaldehyde,
4750-17-8,
1,3-cyclopentanedicarbaldehyde,
SCHEMBL3692803,
JWWOLXQVNVCQSJ-UHFFFAOYSA-N,
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| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 126.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 126.155g/mol |
| Monoisotopic Mass | 126.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
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Certificate of Analysis
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