| CAS Number | 875213-03-9 |
| Catalog Number | AG008C4M(AGN-PC-04PQWB) |
| Chemical Name | 4-(2-Methoxyethoxy)butanenitrile |
| IUPAC Name | 4-(2-methoxyethoxy)butanenitrile |
| InChI | InChI=1S/C7H13NO2/c1-9-6-7-10-5-3-2-4-8/h2-3,5-7H2,1H3 |
| InChI Key | MLSZUYZVLRJQHK-UHFFFAOYSA-N |
| MDL Number | MFCD09948280 |
| Molecular Formula | C7H13NO2 |
| Molecular Weight | 143.1836 |
| SMILES | COCCOCCCC#N |
| Synonyms | 4-(2-methoxyethoxy)butanenitrile,
875213-03-9,
Butanenitrile, 4-(2-methoxyethoxy)-,
AC1Q4GCG,
CTK3C3382,
DTXSID30640953,
ZINC19513933,
AKOS000193382,
MCULE-9069502271,
NE51795,
EN300-52580,
Z1251171267,
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| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.186g/mol |
| Monoisotopic Mass | 143.095g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
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Certificate of Analysis
Lot Number