| CAS Number | 17027-50-8 |
| Catalog Number | AG00J2Q4(AGN-PC-0O4TBZ) |
| Chemical Name | (S)-3-(2,5-Dioxoimidazolidin-4-yl)propanoic acid |
| IUPAC Name | 3-[(4S)-2,5-dioxoimidazolidin-4-yl]propanoic acid |
| InChI | InChI=1S/C6H8N2O4/c9-4(10)2-1-3-5(11)8-6(12)7-3/h3H,1-2H2,(H,9,10)(H2,7,8,11,12)/t3-/m0/s1 |
| InChI Key | VWFWNXQAMGDPGG-VKHMYHEASA-N |
| MDL Number | MFCD20642114 |
| Molecular Formula | C6H8N2O4 |
| Molecular Weight | 172.1387 |
| SMILES | O=C1NC([C@@H](N1)CCC(=O)O)=O |
| Synonyms | 3-[(4S)-2,5-dioxo-4-imidazolidinyl]propanoic acid,
3-[(4S)-2,5-dioxoimidazolidin-4-yl]propanoic acid,
17027-50-8,
AC1LEPGS,
SCHEMBL17830319,
ZINC112609,
ZX-CM010387,
MFCD20642114,
FCH1221917,
FS-4535,
AJ-11396,
Y-8424,
4045608-25G,
4045608-50G,
DI6,
Hydantoin-propionate,
CID715854,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.14g/mol |
| Monoisotopic Mass | 172.048g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 95.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number