| CAS Number | 1376099-80-7 |
| Catalog Number | AG0013M8(AGN-PC-09RVMF) |
| Chemical Name | 1-Piperazinecarboxylic acid, 3-(aminomethyl)-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 3-(aminomethyl)piperazine-1-carboxylate |
| InChI | InChI=1S/C10H21N3O2/c1-10(2,3)15-9(14)13-5-4-12-8(6-11)7-13/h8,12H,4-7,11H2,1-3H3 |
| InChI Key | SYPBUUQIMIYTEN-UHFFFAOYSA-N |
| MDL Number | MFCD22056449 |
| Molecular Formula | C10H21N3O2 |
| Molecular Weight | 215.2926 |
| SMILES | CC(C)(C)OC(=O)N1CCNC(CN)C1 |
| Synonyms | tert-Butyl 3-(aminomethyl)piperazine-1-carboxylate,
1376099-80-7,
SCHEMBL17062766,
DTXSID40696729,
SYPBUUQIMIYTEN-UHFFFAOYSA-N,
6600AA,
AKOS016008961,
MCULE-9271236450,
NE16797,
Z1354602523,
3-aminomethyl-piperazine-1-carboxylic acid tert-butyl ester,
1-Piperazinecarboxylic acid, 3-(aminomethyl)-, 1,1-dimethylethyl ester,
C10H21N3O2,
tert-Butyl3-(aminomethyl)piperazine-1-carboxylate,
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| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.297g/mol |
| Monoisotopic Mass | 215.163g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number