| CAS Number | 78520-05-5 |
| Catalog Number | AG00ICY9(AGN-PC-0NJZBQ) |
| Chemical Name | 3-Furaldehyde dimethyl acetal |
| IUPAC Name | 3-(dimethoxymethyl)furan |
| InChI | InChI=1S/C7H10O3/c1-8-7(9-2)6-3-4-10-5-6/h3-5,7H,1-2H3 |
| InChI Key | KUETZVIRNLYYLC-UHFFFAOYSA-N |
| MDL Number | MFCD28679256 |
| Molecular Formula | C7H10O3 |
| Molecular Weight | 142.1525 |
| SMILES | COC(c1cocc1)OC |
| Synonyms | 3-Furaldehyde dimethyl acetal,
78520-05-5,
Furan, 3-(dimethoxymethyl)-,
SCHEMBL7373260,
3-(dimethoxymethyl)furan,
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| Complexity | 90.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.154g/mol |
| Monoisotopic Mass | 142.063g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 31.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number