| CAS Number | 16517-53-6 |
| Catalog Number | AG01AINC(AGN-PC-0JMZZB) |
| Chemical Name | (3-hydroxypropyl)urea |
| IUPAC Name | 3-hydroxypropylurea |
| InChI | InChI=1S/C4H10N2O2/c5-4(8)6-2-1-3-7/h7H,1-3H2,(H3,5,6,8) |
| InChI Key | DNPHEDNKXRMPAX-UHFFFAOYSA-N |
| MDL Number | MFCD01676014 |
| Molecular Formula | C4H10N2O2 |
| Molecular Weight | 118.1344 |
| SMILES | NC(NCCCO)=O |
| Synonyms | (3-Hydroxypropyl)urea,
Urea, (3-hydroxypropyl)-,
16517-53-6,
3-hydroxypropylurea,
BRN 2038523,
Urea, N-(3-hydroxypropyl)-,
AC1L4CPM,
1-(3-hydroxypropyl)urea,
SCHEMBL193545,
DTXSID10167850,
ZINC3632636,
AKOS009096248,
NE18647,
LS-160345,
EN300-78436,
C4-H10-N2-O2,
CID204506,
|
| Complexity | 74.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 118.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 118.136g/mol |
| Monoisotopic Mass | 118.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 75.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number