| CAS Number | 771499-64-0 |
| Catalog Number | AG00G9MH(AGN-PC-0WA77I) |
| Chemical Name | 3-(2-Chloroacetyl)-1-cyclopropylurea |
| IUPAC Name | 2-chloro-N-(cyclopropylcarbamoyl)acetamide |
| InChI | InChI=1S/C6H9ClN2O2/c7-3-5(10)9-6(11)8-4-1-2-4/h4H,1-3H2,(H2,8,9,10,11) |
| InChI Key | XWUSXXUJONYTSB-UHFFFAOYSA-N |
| MDL Number | MFCD06347921 |
| Molecular Formula | C6H9ClN2O2 |
| Molecular Weight | 176.6009 |
| SMILES | ClCC(NC(NC1CC1)=O)=O |
| Synonyms | 3-(2-Chloroacetyl)-1-cyclopropylurea,
771499-64-0,
2-chloro-N-[(cyclopropylamino)carbonyl]acetamide,
AC1Q3TH2,
AC1M192X,
CTK6H5199,
ZINC2628572,
KM1823,
AKOS008967589,
MCULE-8500559808,
2-chloro-N-(cyclopropylcarbamoyl)acetamide,
V7701,
EN300-10480,
C6H9ClN2O2,
ZINC02628572,
CID2090935,
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| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.6g/mol |
| Monoisotopic Mass | 176.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number