| CAS Number | 1184266-90-7 |
| Catalog Number | AG01A8X6 |
| Chemical Name | 4-(2-cyclohexylacetamido)cyclohexane-1-carboxylic acid |
| IUPAC Name | 4-[(2-cyclohexylacetyl)amino]cyclohexane-1-carboxylic acid |
| InChI | InChI=1S/C15H25NO3/c17-14(10-11-4-2-1-3-5-11)16-13-8-6-12(7-9-13)15(18)19/h11-13H,1-10H2,(H,16,17)(H,18,19) |
| InChI Key | IJAIKLQYPUEBME-UHFFFAOYSA-N |
| MDL Number | MFCD12727602 |
| Molecular Formula | C15H25NO3 |
| Molecular Weight | 267.3639 |
| SMILES | OC(C1CCC(NC(CC2CCCCC2)=O)CC1)=O |
| Synonyms | 4-(2-cyclohexylacetamido)cyclohexane-1-carboxylic acid,
1184266-90-7,
AC1Q74EU,
ZINC37561611,
AKOS010025365,
MCULE-8767795560,
NE18866,
EN300-62814,
Z1259161863,
|
| Complexity | 315 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.369g/mol |
| Monoisotopic Mass | 267.183g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number