| CAS Number | 97935-32-5 |
| Catalog Number | AG01DWXM(AGN-PC-00MHNI) |
| Chemical Name | 1,1-dimethyl 2-methylcyclopropane-1,1-dicarboxylate |
| IUPAC Name | dimethyl 2-methylcyclopropane-1,1-dicarboxylate |
| InChI | InChI=1S/C8H12O4/c1-5-4-8(5,6(9)11-2)7(10)12-3/h5H,4H2,1-3H3 |
| InChI Key | ZVMMUSUTUJIKID-UHFFFAOYSA-N |
| MDL Number | MFCD26868093 |
| Molecular Formula | C8H12O4 |
| Molecular Weight | 172.1785 |
| SMILES | COC(C1(C(OC)=O)C(C)C1)=O |
| Synonyms | 1,1-dimethyl 2-methylcyclopropane-1,1-dicarboxylate,
97935-32-5,
SCHEMBL9017773,
ZVMMUSUTUJIKID-UHFFFAOYSA-N,
1,1-Dicarbomethoxy-2-methylcyclopropane,
2-Methyl-1,1-cyclopropanedicarboxylic acid dimethyl ester,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.18g/mol |
| Monoisotopic Mass | 172.074g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number