| CAS Number | 55956-25-7 |
| Catalog Number | AG00372P(AGN-PC-0JKS8D) |
| Chemical Name | 1-[1-MEthyl-2-(2-Propenyloxy)Ethoxy]-2-Propanol |
| IUPAC Name | 1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol |
| InChI | InChI=1S/C9H18O3/c1-4-5-11-7-9(3)12-6-8(2)10/h4,8-10H,1,5-7H2,2-3H3 |
| InChI Key | PDCBTSVBFUQBNN-UHFFFAOYSA-N |
| MDL Number | MFCD18973004 |
| Molecular Formula | C9H18O3 |
| Molecular Weight | 174.2374 |
| SMILES | CC(O)COC(C)COCC=C |
| Synonyms | 55956-25-7,
1-(1-prop-2-enoxypropan-2-yloxy)propan-2-ol,
1-[1-methyl-2-(2-propenyloxy)ethoxy]-2-propanol,
2-Propanol, 1-[1-methyl-2-(2-propenyloxy)ethoxy]-,
1-[2-(Allyloxy)-1-methylethoxy]-2-propanol,
2-Propanol, 1-(1-methyl-2-(2-propenyloxy)ethoxy)-,
SCHEMBL133184,
AC1L269J,
CTK1H3042,
PDCBTSVBFUQBNN-UHFFFAOYSA-N,
1-[2-(Allyloxy)-1-methylethoxy]-2-propanol #,
CID41674,
1-[1-Methyl-2- ethoxy]-2-propanol,
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| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.24g/mol |
| Monoisotopic Mass | 174.126g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number