| CAS Number | 39804-95-0 |
| Catalog Number | AG01E719(AGN-PC-00MJIQ) |
| Chemical Name | 1-cyclopentyl-3-methylurea |
| IUPAC Name | 1-cyclopentyl-3-methylurea |
| InChI | InChI=1S/C7H14N2O/c1-8-7(10)9-6-4-2-3-5-6/h6H,2-5H2,1H3,(H2,8,9,10) |
| InChI Key | UQHLFZVUHJUWGD-UHFFFAOYSA-N |
| MDL Number | MFCD08722291 |
| Molecular Formula | C7H14N2O |
| Molecular Weight | 142.1989 |
| SMILES | CNC(NC1CCCC1)=O |
| Synonyms | 1-cyclopentyl-3-methylurea,
39804-95-0,
N'-cyclopentyl-methyl-urea,
N-cyclopentyl-N'-methylurea,
SCHEMBL967798,
UQHLFZVUHJUWGD-UHFFFAOYSA-N,
ZINC9875465,
STK520710,
AKOS004093063,
MCULE-2695826124,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.202g/mol |
| Monoisotopic Mass | 142.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number