| CAS Number | 40203-74-5 |
| Catalog Number | AG007416(AGN-PC-0NGBI5) |
| Chemical Name | Methyl 2-cyclohexylideneacetate |
| IUPAC Name | methyl 2-cyclohexylideneacetate |
| InChI | InChI=1S/C9H14O2/c1-11-9(10)7-8-5-3-2-4-6-8/h7H,2-6H2,1H3 |
| InChI Key | SSYXINHPLNNOSJ-UHFFFAOYSA-N |
| MDL Number | MFCD09866830 |
| Molecular Formula | C9H14O2 |
| Molecular Weight | 154.2063 |
| SMILES | COC(/C=C1CCCCC1)=O |
| Synonyms | Methyl 2-cyclohexylideneacetate,
40203-74-5,
methyl cyclohexylideneacetate,
Acetic acid, cyclohexylidene-, methyl ester,
SCHEMBL106091,
CTK1D4722,
DTXSID10456079,
SSYXINHPLNNOSJ-UHFFFAOYSA-N,
ZINC38282124,
3,3-Pentanoacrylic acid methyl ester,
AKOS017437671,
MCULE-4895716264,
cyclohexylidene-acetic acid methyl ester,
Aceticacid,2-cyclohexylidene-,methylester,
CID11126470,
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| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.209g/mol |
| Monoisotopic Mass | 154.099g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number