| CAS Number | 749920-12-5 |
| Catalog Number | AG00G44I |
| Chemical Name | (1-Methoxypropan-2-yl)urea |
| IUPAC Name | 1-methoxypropan-2-ylurea |
| InChI | InChI=1S/C5H12N2O2/c1-4(3-9-2)7-5(6)8/h4H,3H2,1-2H3,(H3,6,7,8) |
| InChI Key | LWKISYQIMODBPM-UHFFFAOYSA-N |
| MDL Number | MFCD06336969 |
| Molecular Formula | C5H12N2O2 |
| Molecular Weight | 132.1610 |
| SMILES | O=C(N)NC(C)COC |
| Synonyms | (1-methoxypropan-2-yl)urea,
N-(2-methoxy-1-methylethyl)urea,
749920-12-5,
AC1MVJOY,
AC1Q4FIC,
1-methoxypropan-2-ylurea,
SCHEMBL4109967,
CTK6B0040,
HMS1727I19,
AKOS000199393,
AKOS016881394,
MCULE-1001849810,
NE21018,
EN300-09828,
ZINC02656367,
CID3684317,
|
| Complexity | 95 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 132.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 132.163g/mol |
| Monoisotopic Mass | 132.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number