| CAS Number | 1345471-39-7 |
| Catalog Number | AG007ZXT(AGN-PC-0WA5AB) |
| Chemical Name | 1-(Cyclopropylmethyl)-5-iodopyrazole |
| IUPAC Name | 1-(cyclopropylmethyl)-5-iodopyrazole |
| InChI | InChI=1S/C7H9IN2/c8-7-3-4-9-10(7)5-6-1-2-6/h3-4,6H,1-2,5H2 |
| InChI Key | ZHDDOQWIKLEOBV-UHFFFAOYSA-N |
| MDL Number | MFCD20441941 |
| Molecular Formula | C7H9IN2 |
| Molecular Weight | 248.0642 |
| SMILES | Ic1ccnn1CC1CC1 |
| Synonyms | 1345471-39-7,
1-(Cyclopropylmethyl)-5-iodo-1H-pyrazole,
1-(Cyclopropylmethyl)-5-iodopyrazole,
ACMC-209bva,
CTK8B0233,
DTXSID10718447,
ANW-19652,
MFCD20441941,
ZINC74937922,
AKOS022173339,
AJ-121509,
TC-108397,
Z9776,
K-4245,
C7H9IN2,
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| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.981g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.067g/mol |
| Monoisotopic Mass | 247.981g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number