76714-83-5
UNICONAZOLE
Name
UNICONAZOLE
Formula
C15 H18 Cl N3 O
MolWeight
291.78
1Identification
【Name】
UNICONAZOLE
【CAS】
83657-17-4
;76714-83-5
;83657-22-1
【MDL】
MFCD01678674
【English Synonyms】
【Formula】
C15 H18 Cl N3 O
【MolWeight】
291.78
【Inchi】
InChI=1S/C15H18ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-10,14,20H,1-3H3/b13-8+
【InChIKey】
InChIKey=YNWVFADWVLCOPU-MDWZMJQESA-N
【SMILES】
CC(C)(C)C(/C(=C\c1ccc(cc1)Cl)/n2cncn2)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
UNICONAZOLE.cml
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