| CAS Number | 1057393-54-0 |
| Catalog Number | AG019XU3(AGN-PC-0WOD7E) |
| Chemical Name | 3-Amino-1-(cyclopropylmethyl)urea |
| IUPAC Name | 1-amino-3-(cyclopropylmethyl)urea |
| InChI | InChI=1S/C5H11N3O/c6-8-5(9)7-3-4-1-2-4/h4H,1-3,6H2,(H2,7,8,9) |
| InChI Key | CYSBNZFHSKCRIG-UHFFFAOYSA-N |
| MDL Number | MFCD11212750 |
| Molecular Formula | C5H11N3O |
| Molecular Weight | 129.1603 |
| SMILES | NNC(NCC1CC1)=O |
| Synonyms | 3-amino-1-(cyclopropylmethyl)urea,
1057393-54-0,
CTK7F1338,
AC1Q5506,
ZINC36948183,
AKOS009344707,
NE44318,
EN300-56044,
|
| Complexity | 111 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.163g/mol |
| Monoisotopic Mass | 129.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.2 |
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Certificate of Analysis
Lot Number