| CAS Number | 1260760-22-2 |
| Catalog Number | AG000R49(AGN-PC-09RZJW) |
| Chemical Name | Benzyl 4-(methoxy(methyl)amino)-4-oxobutanoate |
| IUPAC Name | benzyl 4-[methoxy(methyl)amino]-4-oxobutanoate |
| InChI | InChI=1S/C13H17NO4/c1-14(17-2)12(15)8-9-13(16)18-10-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3 |
| InChI Key | YZTCKSAAPZMJPP-UHFFFAOYSA-N |
| MDL Number | MFCD11975779 |
| Molecular Formula | C13H17NO4 |
| Molecular Weight | 251.2784 |
| SMILES | CON(C)C(=O)CCC(=O)OCC1=CC=CC=C1 |
| Synonyms | benzyl 4-[methoxy(methyl)amino]-4-oxobutanoate,
1260760-22-2,
BENZYL 4-(METHOXY(METHYL)AMINO)-4-OXOBUTANOATE,
6538AJ,
MFCD11975779,
ZINC90556486,
AKOS024256420,
TRA0037184,
KS-00000B98,
AS-32370,
CJ-22597,
DA-13315,
SC-33020,
SY022565,
TC-308072,
FT-0744478,
Z-4722,
MFCD11975779 (97+%),
BENZYL4-[METHOXY(METHYL)AMINO]-4-OXOBUTANOATE,
C13H17NO4,
14533-86-9,
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| Complexity | 274 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.282g/mol |
| Monoisotopic Mass | 251.116g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number