| CAS Number | 349545-91-1 |
| Catalog Number | AG00C678(AGN-PC-0WBO5V) |
| Chemical Name | Boc-HSer(Me)-OH DCHA |
| IUPAC Name | N-cyclohexylcyclohexanamine;(2S)-4-methoxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid |
| InChI | InChI=1S/C12H23N.C10H19NO5/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-10(2,3)16-9(14)11-7(8(12)13)5-6-15-4/h11-13H,1-10H2;7H,5-6H2,1-4H3,(H,11,14)(H,12,13)/t;7-/m.0/s1 |
| InChI Key | FWRIXWOUYCASFG-ZLTKDMPESA-N |
| MDL Number | MFCD01861359 |
| Molecular Formula | C22H42N2O5 |
| Molecular Weight | 414.5793 |
| SMILES | C1CCC(CC1)NC1CCCCC1.COCC[C@H](NC(=O)OC(C)(C)C)C(O)=O |
| Synonyms | BOC-HSE(ME)-OH DCHA,
349545-91-1,
Boc-HSer(Me)-OH DCHA,
SCHEMBL12004419,
Boc-Hse(Me)-OH DCHA AldrichCPR,
Boc-Hse(Me)-OH DCHA, AldrichCPR,
6371AH,
MFCD01861359,
K-7937,
N-alpha-t-Butyloxy-O-methyl-L-homoserine dicyclohexylamine,
C12H23N.C10H19NO5,
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| Complexity | 362 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 414.309g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 414.587g/mol |
| Monoisotopic Mass | 414.309g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 96.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number