| CAS Number | 21855-75-4 |
| Catalog Number | AG007P0D(AGN-PC-0459U7) |
| Chemical Name | Benzyl N-[(butylcarbamoyl)methyl]carbamate |
| IUPAC Name | benzyl N-[2-(butylamino)-2-oxoethyl]carbamate |
| InChI | InChI=1S/C14H20N2O3/c1-2-3-9-15-13(17)10-16-14(18)19-11-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,15,17)(H,16,18) |
| InChI Key | SDXXZHZRBSSKNU-UHFFFAOYSA-N |
| MDL Number | MFCD00686952 |
| Molecular Formula | C14H20N2O3 |
| Molecular Weight | 264.3202 |
| SMILES | CCCCNC(=O)CNC(=O)OCc1ccccc1 |
| Synonyms | Benzyl N-[(butylcarbamoyl)methyl]carbamate,
21855-75-4,
Benzyl (2-(butylamino)-2-oxoethyl)carbamate,
Benzyl [2-(butylamino)-2-oxoethyl]carbamate,
ACMC-209for,
CTK8B1207,
DTXSID40634984,
ANW-24601,
MFCD00686952,
ZINC49398145,
CJ-20598,
AJ-111021,
TC-113346,
V4394,
B-7912,
C14H20N2O3,
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| Complexity | 276 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 264.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.325g/mol |
| Monoisotopic Mass | 264.147g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number