55661-18-2
5-ETHYL-5-(3-HYDROXYPENTYL)BARBITURIC ACID
Name5-ETHYL-5-(3-HYDROXYPENTYL)BARBITURIC ACID
1Identification
【Name】
5-ETHYL-5-(3-HYDROXYPENTYL)BARBITURIC ACID
【CAS】
【MDL】
MFCD18972677
【English Synonyms】
【Formula】
C11 H18 N2 O4
【MolWeight】
242.273
【Inchi】
InChI=1S/C11H18N2O4/c1-3-7(14)5-6-11(4-2)8(15)12-10(17)13-9(11)16/h7,14H,3-6H2,1-2H3,(H2,12,13,15,16,17)
【InChIKey】
InChIKey=RRUUJZNGKNJXFI-UHFFFAOYSA-N
【SMILES】
CCC(CCC1(C(=O)NC(=O)NC1=O)CC)O
【MOL File】
5-ETHYL-5-(3-HYDROXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-ETHYL-5-(3-HYDROXYPENTYL)BARBITURIC ACID.cml