| CAS Number | 1245649-33-5 |
| Catalog Number | AG009XCB(AGN-PC-0WACKD) |
| Chemical Name | Benzylmethyl(pyrrolidin-3-ylmethyl)carbamate |
| IUPAC Name | benzyl N-methyl-N-(pyrrolidin-3-ylmethyl)carbamate |
| InChI | InChI=1S/C14H20N2O2/c1-16(10-13-7-8-15-9-13)14(17)18-11-12-5-3-2-4-6-12/h2-6,13,15H,7-11H2,1H3 |
| InChI Key | XPQDOUKRHNPOQO-UHFFFAOYSA-N |
| MDL Number | MFCD08061961 |
| Molecular Formula | C14H20N2O2 |
| Molecular Weight | 248.3208 |
| SMILES | CN(CC1CCNC1)C(=O)OCc1ccccc1 |
| Synonyms | 1245649-33-5,
benzyl methyl(pyrrolidin-3-ylmethyl)carbamate,
Methyl-pyrrolidin-3-ylmethyl-carbamic acid benzyl ester,
Benzylmethyl(pyrrolidin-3-ylmethyl)carbamate,
Benzyl methyl[(pyrrolidin-3-yl)methyl]carbamate,
DTXSID40696724,
MFCD08061961,
AKOS005258667,
AM91226,
SC-35599,
DB-062287,
FT-0707986,
Z3094,
B-1656,
3-N-CBZ-3-N-METHYL-AMINOMETHYL PYRROLIDINE,
benzyl N-methyl-N-(pyrrolidin-3-ylmethyl)carbamate,
C14H20N2O2,
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| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.326g/mol |
| Monoisotopic Mass | 248.152g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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