| CAS Number | 1056441-60-1 |
| Catalog Number | AG0095RE(AGN-PC-0WCY20) |
| Chemical Name | tert-Butyl bis(4-hydroxybutyl)carbamate |
| IUPAC Name | tert-butyl N,N-bis(4-hydroxybutyl)carbamate |
| InChI | InChI=1S/C13H27NO4/c1-13(2,3)18-12(17)14(8-4-6-10-15)9-5-7-11-16/h15-16H,4-11H2,1-3H3 |
| InChI Key | LYKKTHBCVTULDS-UHFFFAOYSA-N |
| MDL Number | MFCD28053466 |
| Molecular Formula | C13H27NO4 |
| Molecular Weight | 261.3578 |
| SMILES | O=C(OC(C)(C)C)N(CCCCO)CCCCO |
| Synonyms | tert-Butyl bis(4-hydroxybutyl)carbamate,
1056441-60-1,
AKOS026674216,
ZINC299803943,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.362g/mol |
| Monoisotopic Mass | 261.194g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 70A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number