| CAS Number | 54609-12-0 |
| Catalog Number | AG00DKFH(AGN-PC-0WOE0P) |
| Chemical Name | 1-Cyclopropyl-2,5-dimethylpyrrole |
| IUPAC Name | 1-cyclopropyl-2,5-dimethylpyrrole |
| InChI | InChI=1S/C9H13N/c1-7-3-4-8(2)10(7)9-5-6-9/h3-4,9H,5-6H2,1-2H3 |
| InChI Key | ZHAYXRUZLFCGLF-UHFFFAOYSA-N |
| MDL Number | MFCD12187123 |
| Molecular Formula | C9H13N |
| Molecular Weight | 135.2062 |
| SMILES | Cc1ccc(n1C1CC1)C |
| Synonyms | 1-Cyclopropyl-2,5-dimethylpyrrole,
54609-12-0,
1-Cyclopropyl-2,5-dimethyl-1H-pyrrole,
ACMC-209lhw,
SCHEMBL16720236,
CTK8B1873,
DTXSID40512475,
ANW-32130,
MFCD12187123,
ZINC35120316,
AKOS008965837,
TC-120875,
V6543,
B-8455,
C9H13N,
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| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.21g/mol |
| Monoisotopic Mass | 135.105g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 4.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number