| CAS Number | 1260088-70-7 |
| Catalog Number | AG00IUJB(AGN-PC-0WAZOT) |
| Chemical Name | Methyl 4-amino-5,5-dimethyl-2,5-dihydrofuran-3-carboxylate |
| IUPAC Name | methyl 4-amino-5,5-dimethyl-2H-furan-3-carboxylate |
| InChI | InChI=1S/C8H13NO3/c1-8(2)6(9)5(4-12-8)7(10)11-3/h4,9H2,1-3H3 |
| InChI Key | GLSSJSJNRMDYHJ-UHFFFAOYSA-N |
| MDL Number | MFCD19703786 |
| Molecular Formula | C8H13NO3 |
| Molecular Weight | 171.1937 |
| SMILES | O=C(OC)C1(=C(N)C(C)(C)OC1) |
| Synonyms | methyl 4-amino-5,5-dimethyl-2,5-dihydrofuran-3-carboxylate,
1260088-70-7,
SCHEMBL2707841,
GLSSJSJNRMDYHJ-UHFFFAOYSA-N,
KS-000025KI,
AKOS024462319,
ZINC141269657,
GS-0624,
|
| Complexity | 243 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.196g/mol |
| Monoisotopic Mass | 171.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
Lot Number