| CAS Number | 57234-29-4 |
| Catalog Number | AG00IMEN(AGN-PC-0NI54H) |
| Chemical Name | Benzene, 1,3-bis(methoxymethoxy)- |
| IUPAC Name | 1,3-bis(methoxymethoxy)benzene |
| InChI | InChI=1S/C10H14O4/c1-11-7-13-9-4-3-5-10(6-9)14-8-12-2/h3-6H,7-8H2,1-2H3 |
| InChI Key | TZZPMRGYEPMHLA-UHFFFAOYSA-N |
| MDL Number | MFCD27925713 |
| Molecular Formula | C10H14O4 |
| Molecular Weight | 198.2158 |
| SMILES | COCOc1cccc(c1)OCOC |
| Synonyms | 1,3-Bis(methoxymethoxy)benzene,
1,3-di(methoxymethoxy)benzene,
57234-29-4,
Resorcinol Bis(methoxymethyl) Ether,
SCHEMBL1607526,
TZZPMRGYEPMHLA-UHFFFAOYSA-N,
MFCD27925713,
ZINC38892278,
1,3-bis{[(methyloxy)methyl]oxy}benzene,
DA-42053,
B5643,
FT-0712579,
|
| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.218g/mol |
| Monoisotopic Mass | 198.089g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 36.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number