831239-25-9
4-[(2-BROMOPHENYL)METHOXY]BENZONITRILE
Name4-[(2-BROMOPHENYL)METHOXY]BENZONITRILE
1Identification
【Name】
4-[(2-BROMOPHENYL)METHOXY]BENZONITRILE
【CAS】
【MDL】
MFCD06627042
【English Synonyms】
【Formula】
C14 H10 Br N O
【MolWeight】
288.143
【Inchi】
InChI=1S/C14H10BrNO/c15-14-4-2-1-3-12(14)10-17-13-7-5-11(9-16)6-8-13/h1-8H,10H2
【InChIKey】
InChIKey=XWPNRRLPTICAKE-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)COc2ccc(cc2)C#N)Br
【MOL File】
4-[(2-BROMOPHENYL)ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[(2-BROMOPHENYL)METHOXY]BENZONITRILE.cml