| CAS Number | 63942-64-3 |
| Catalog Number | AG00ELE3(AGN-PC-038AUB) |
| Chemical Name | 2-(2-Cyclohexylacetamido)acetic acid |
| IUPAC Name | 2-[(2-cyclohexylacetyl)amino]acetic acid |
| InChI | InChI=1S/C10H17NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h8H,1-7H2,(H,11,12)(H,13,14) |
| InChI Key | VDNMXWRIILTOEY-UHFFFAOYSA-N |
| MDL Number | MFCD11169978 |
| Molecular Formula | C10H17NO3 |
| Molecular Weight | 199.2469 |
| SMILES | OC(CNC(CC1CCCCC1)=O)=O |
| Synonyms | 2-(2-cyclohexylacetamido)acetic acid,
63942-64-3,
N-(Cyclohexylacetyl)glycine,
SCHEMBL6137896,
Glycine, N-(cyclohexylacetyl)-,
CTK2A7802,
DTXSID40611356,
AC1Q7600,
ZINC20250019,
AKOS008984612,
MCULE-6241886212,
NE28076,
EN300-61471,
Z85887051,
2-[(2-cyclohexylacetyl)amino]acetic acid,
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| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.25g/mol |
| Monoisotopic Mass | 199.121g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 66.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number