94692-00-9
4,5-DIHYDRO-3-METHYL-5-OXO-1H-FURO[2,3-C]PYRAZOLE-4-CARBONITRILE
Name4,5-DIHYDRO-3-METHYL-5-OXO-1H-FURO[2,3-C]PYRAZOLE-4-CARBONITRILE
1Identification
【Name】
4,5-DIHYDRO-3-METHYL-5-OXO-1H-FURO[2,3-C]PYRAZOLE-4-CARBONITRILE
【CAS】
【MDL】
MFCD15144057
【English Synonyms】
【Formula】
C7 H5 N3 O2
【MolWeight】
163.135
【Inchi】
InChI=1S/C7H5N3O2/c1-3-5-4(2-8)7(11)12-6(5)10-9-3/h4H,1H3,(H,9,10)
【InChIKey】
InChIKey=KBZHVPAUAZGWLH-UHFFFAOYSA-N
【SMILES】
Cc1c2c([nH]n1)OC(=O)C2C#N
【MOL File】
4,5-DIHYDRO-3-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4,5-DIHYDRO-3-METHYL-5-OXO-1H-FURO[2,3-C]PYRAZOLE-4-CARBONITRILE.cml