| CAS Number | 5544-34-3 |
| Catalog Number | AG00DMRE(AGN-PC-0KFEUR) |
| Chemical Name | N-(Allylcarbamoyl)-2-chloroacetamide |
| IUPAC Name | 2-chloro-N-(prop-2-enylcarbamoyl)acetamide |
| InChI | InChI=1S/C6H9ClN2O2/c1-2-3-8-6(11)9-5(10)4-7/h2H,1,3-4H2,(H2,8,9,10,11) |
| InChI Key | NSLCBCXTRMVMJA-UHFFFAOYSA-N |
| MDL Number | MFCD03983039 |
| Molecular Formula | C6H9ClN2O2 |
| Molecular Weight | 176.6009 |
| SMILES | ClCC(NC(NCC=C)=O)=O |
| Synonyms | 5544-34-3,
1-Allyl-3-(2-chloro-acetyl)-urea,
2-chloro-N-(prop-2-enylcarbamoyl)acetamide,
N-(Allylcarbamoyl)-2-chloroacetamide,
1-(2-chloroacetyl)-3-(prop-2-en-1-yl)urea,
1-chloroacetyl-3-allylurea,
AC1Q3TH6,
AC1M66K9,
CTK1H1223,
DTXSID70368285,
ZINC3250172,
AKOS008966950,
MCULE-4444613676,
NE35254,
EN300-05661,
2-Chloro-N-[(prop-2-en-1-yl)carbamoyl]acetamide,
1-ALLYL-3- -UREA,
ZINC03250172,
CID2367276,
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| Complexity | 170 |
| 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 | 3 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number