113411-11-3
3-(4-CYANO-3-BETA-HYDROXYETHYLMERCAPTO-2-OXOBUTYLIDENEAMINO)-2-OXAZOLIDONE
Name3-(4-CYANO-3-BETA-HYDROXYETHYLMERCAPTO-2-OXOBUTYLIDENEAMINO)-2-OXAZOLIDONE
1Identification
【Name】
3-(4-CYANO-3-BETA-HYDROXYETHYLMERCAPTO-2-OXOBUTYLIDENEAMINO)-2-OXAZOLIDONE
【CAS】
【MDL】
MFCD01709288
【English Synonyms】
【Formula】
C10 H13 N3 O4 S
【MolWeight】
271.296
【Inchi】
InChI=1S/C10H13N3O4S/c11-2-1-9(18-6-4-14)8(15)7-12-13-3-5-17-10(13)16/h7,9,14H,1,3-6H2/b12-7+
【InChIKey】
InChIKey=MBSMKAWUFQXZME-KPKJPENVSA-N
【SMILES】
C1COC(=O)N1/N=C/C(=O)C(CC#N)SCCO
【MOL File】
3-(4-CYANO-3-BETA-HY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:-2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(4-CYANO-3-BETA-HYDROXYETHYLMERCAPTO-2-OXOBUTYLIDENEAMINO)-2-OXAZOLIDONE.cml