| CAS Number | 94487-74-8 |
| Catalog Number | AG003NWB(AGN-PC-0W439V) |
| Chemical Name | (Z)-2-Methylbut-2-enoic anhydride |
| IUPAC Name | [(Z)-2-methylbut-2-enoyl] (Z)-2-methylbut-2-enoate |
| InChI | InChI=1S/C10H14O3/c1-5-7(3)9(11)13-10(12)8(4)6-2/h5-6H,1-4H3/b7-5-,8-6- |
| InChI Key | LIHLSLRANKCHLV-SFECMWDFSA-N |
| MDL Number | MFCD00198080 |
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.2164 |
| SMILES | C/C=C(C)C(OC(/C(C)=CC)=O)=O |
| Synonyms | Angelic Anhydride,
94487-74-8,
(Z)-2-Methylbut-2-enoic anhydride,
2-Methylisocrotonic Anhydride,
SCHEMBL15101930,
LIHLSLRANKCHLV-SFECMWDFSA-N,
(Z)-2-Methyl-2-butenoic Anhydride,
MFCD00198080,
AKOS024258413,
ZINC100009111,
AK154777,
AX8114342,
A1180,
ST24036516,
AngelicAnhydride,
ACN-035809,
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| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Exact Mass | 182.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.219g/mol |
| Monoisotopic Mass | 182.094g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 43.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number