document.write('
161718-81-6
4-ISOBUTYLOXY-1,3-BENZENEDICARBONITRILE
Name
4-ISOBUTYLOXY-1,3-BENZENEDICARBONITRILE
Formula
C12 H12 N2 O
MolWeight
200.24
1Identification
【Name】
4-ISOBUTYLOXY-1,3-BENZENEDICARBONITRILE
【CAS】
【MDL】
MFCD13185905
【English Synonyms】
【Formula】
C12 H12 N2 O
【MolWeight】
200.24
【Inchi】
InChI=1S/C12H12N2O/c1-9(2)8-15-12-4-3-10(6-13)5-11(12)7-14/h3-5,9H,8H2,1-2H3
【InChIKey】
InChIKey=CTQZRQNRVCZKOE-UHFFFAOYSA-N
【SMILES】
CC(C)COc1ccc(cc1C#N)C#N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4-ISOBUTYLOXY-1,3-BENZENEDICARBONITRILE.cml
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