| CAS Number | 32691-93-3 |
| Catalog Number | AG00I67V(AGN-PC-00CF5J) |
| Chemical Name | Benzene, 1-(dimethoxymethyl)-4-fluoro- |
| IUPAC Name | 1-(dimethoxymethyl)-4-fluorobenzene |
| InChI | InChI=1S/C9H11FO2/c1-11-9(12-2)7-3-5-8(10)6-4-7/h3-6,9H,1-2H3 |
| InChI Key | SOZXXYJDCMNWCS-UHFFFAOYSA-N |
| MDL Number | MFCD30527664 |
| Molecular Formula | C9H11FO2 |
| Molecular Weight | 170.1808 |
| SMILES | COC(c1ccc(cc1)F)OC |
| Synonyms | 1-(Dimethoxymethyl)-4-fluorobenzene,
4-Fluorobenzaldehyde dimethyl acetal,
32691-93-3,
SCHEMBL6205426,
SOZXXYJDCMNWCS-UHFFFAOYSA-N,
1-(dimethoxymethyl)-4-fluoro-benzene,
CID11600744,
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| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.183g/mol |
| Monoisotopic Mass | 170.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
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