500315-80-0
N-(2-FLUOROETHYL)-N-(1,2,3,4-TETRAHYDRO-2,4-DIOXO-5-PYRIMIDINYL)-UREA
NameN-(2-FLUOROETHYL)-N-(1,2,3,4-TETRAHYDRO-2,4-DIOXO-5-PYRIMIDINYL)-UREA
1Identification
【Name】
N-(2-FLUOROETHYL)-N-(1,2,3,4-TETRAHYDRO-2,4-DIOXO-5-PYRIMIDINYL)-UREA
【CAS】
【MDL】
MFCD18835783
【English Synonyms】
【Formula】
C7 H9 F N4 O3
【MolWeight】
216.171
【Inchi】
InChI=1S/C7H9FN4O3/c8-1-2-12(6(9)14)4-3-10-7(15)11-5(4)13/h3H,1-2H2,(H2,9,14)(H2,10,11,13,15)
【InChIKey】
InChIKey=RHLIEIDJQKLYBS-UHFFFAOYSA-N
【SMILES】
c1c(c(=O)[nH]c(=O)[nH]1)N(CCF)C(=O)N
【MOL File】
N-(2-FLUOROETHYL)-N-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:7
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-FLUOROETHYL)-N-(1,2,3,4-TETRAHYDRO-2,4-DIOXO-5-PYRIMIDINYL)-UREA.cml