| CAS Number | 1257665-22-7 |
| Catalog Number | AG000OOT(AGN-PC-0WNMOJ) |
| Chemical Name | 1-(Cyclopropylmethoxy)-3-(Trifluoromethyl)Benzene |
| IUPAC Name | 1-(cyclopropylmethoxy)-3-(trifluoromethyl)benzene |
| InChI | InChI=1S/C11H11F3O/c12-11(13,14)9-2-1-3-10(6-9)15-7-8-4-5-8/h1-3,6,8H,4-5,7H2 |
| InChI Key | LFSFJZXZWCYIMY-UHFFFAOYSA-N |
| MDL Number | MFCD18087718 |
| Molecular Formula | C11H11F3O |
| Molecular Weight | 216.1996 |
| SMILES | FC(c1cccc(c1)OCC1CC1)(F)F |
| Synonyms | 1-(Cyclopropylmethoxy)-3-(trifluoromethyl)benzene,
1257665-22-7,
ACMC-209b0q,
SCHEMBL2665473,
C11H11F3O,
CTK4B4794,
DTXSID70682170,
ANW-18552,
MFCD18087718,
ZINC65337409,
AKOS015840779,
AJ-115135,
TR-035522,
Z9004,
B-2792,
Benzene, 1-(cyclopropylmethoxy)-3-(trifluoromethyl)-,
I01-11426,
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| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.203g/mol |
| Monoisotopic Mass | 216.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
Lot Number