58537-99-8
4-HYDROXY-2,6-DIMETHYLBENZONITRILE
Name
4-HYDROXY-2,6-DIMETHYLBENZONITRILE
Formula
C9 H9 N O
MolWeight
147.176
1Identification
【Name】
4-HYDROXY-2,6-DIMETHYLBENZONITRILE
【CAS】
【MDL】
MFCD00238591
【English Synonyms】
【Formula】
C9 H9 N O
【MolWeight】
147.176
【Inchi】
InChI=1S/C9H9NO/c1-6-3-8(11)4-7(2)9(6)5-10/h3-4,11H,1-2H3
【InChIKey】
InChIKey=KZEJTKHRBQWACL-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(c1C#N)C)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4-HYDROXY-2,6-DIMETHYLBENZONITRILE.cml
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