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4'-Methyl-2-cyanobiphenyl

4'-Methyl-2-cyanobiphenyl ??? ???
?? ??:
114772-53-1
???:
4'-Methyl-2-cyanobiphenyl
???(??):
OTBN;2-Cyano-4'-methylbiphenyl;2MPPC;AKOS BAR-1203;Sartandiphenyl;Sartanbiphenyl;methyl diphenyl;-2-cyanobiphenyL;2-tolylbenzonitrile;2-hexylbenzonitrile
CBNumber:
CB7337004
???:
C14H11N
??? ??:
193.24
MOL ??:
114772-53-1.mol

4'-Methyl-2-cyanobiphenyl ??

???
49 °C
?? ?
>320°C
??
1,17 g/cm3
???
0.014Pa at 20℃
???
>320°C
?? ??
Sealed in dry,Room Temperature
???
?????(?? ???), ???(?? ???)
??? ??
??? ??
??
???? ?????
BRN
3605954
InChI
InChI=1S/C14H11N/c1-11-6-8-12(9-7-11)14-5-3-2-4-13(14)10-15/h2-9H,1H3
InChIKey
ZGQVZLSNEBEHFN-UHFFFAOYSA-N
SMILES
C1(C2=CC=C(C)C=C2)=CC=CC=C1C#N
LogP
3.5 at 23℃
CAS ??????
114772-53-1(CAS DataBase Reference)
NIST
Benzonitrile, 2-(4-methylphenyl)-(114772-53-1)
??
  • ?? ? ?? ??
  • ?? ? ???? ?? (GHS)
??? ?? Xn,Xi
?? ???? ?? 20/21/22-36/37/38-48/25/62/51/53-22
????? 22-26-36/37/39-36/37/45/57-20-36
WGK ?? 3
?? ?? ?? Irritant
HS ?? 27075000
????(GHS): GHS hazard pictogramsGHS hazard pictogramsGHS hazard pictograms
?? ?: Warning
??·?? ??:
?? ??·?? ?? ?? ?? ?? ?? ? ?? ?? P- ??
H302 ??? ??? ?? ?? ?? - ?? ?? 4 ?? GHS hazard pictograms P264, P270, P301+P312, P330, P501
H312 ??? ???? ??? ?? ?? ?? - ?? ?? 4 ?? GHS hazard pictograms P280,P302+P352, P312, P322, P363,P501
H313 ??? ???? ??? ? ?? ?? ?? ?? - ?? ?? 5 P312
H315 ??? ??? ??? ????? ?? ????? ?? 2 ?? GHS hazard pictograms P264, P280, P302+P352, P321,P332+P313, P362
H319 ?? ?? ??? ??? ?? ? ?? ?? ??? ?? ?? 2A ?? GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
H332 ???? ??? ?? ?? ?? ?? ?? 4 ?? GHS hazard pictograms P261, P271, P304+P340, P312
H361 ?? ?? ????? ??? ??? ??? ??? ???? ?? ?? 2 ?? P201, P202, P281, P308+P313, P405,P501
H372 ??? ?? ?? ???? ??(??, ??? ?? ??? ?? ??? ??)? ??? ??? ?? ???? ?? - ?? ?? ?? 1 ?? GHS hazard pictograms P260, P264, P270, P314, P501
H401 ????? ??? ?? ????? ?? - ?? ?? 2 P273, P501
H411 ??? ??? ?? ????? ??? ?? ????? ?? - ?? ?? 2
??????:
P201 ?? ? ?? ???? ?????.
P260 ??·?·??·???·??·...·????? ???? ???.
P261 ??·?·??·???·??·...·????? ??? ????.
P264 ?? ??? ?? ??? ????.
P264 ?? ??? ?? ??? ????.
P270 ? ??? ??? ??? ???, ???? ???? ???.
P271 ?? ?? ??? ? ?? ???? ?????.
P280 ????/???/???/?????? ?????.
P405 ???? ?????.
P501 ...? ??? / ??? ?? ???.
NFPA 704
1
2 0

4'-Methyl-2-cyanobiphenyl MSDS


2-Cyano-4'-methylbiphenyl

4'-Methyl-2-cyanobiphenyl C??? ??, ??, ??

??? ??

White crystalline powder

??

4'-Methylbiphenyl-2-carbonitrile is an intermediate in the synthesis of glycogen synthase kinase-3 inhibitors with a selective sting for glycogen synthase kinase 3α.

Synthesis

4'-Methyl-2-cyanobiphenyl is prepared by the reaction of o-cyanobromobenzene and potassium (4-methylphenyl)trifluoroborate. The specific synthesis steps are as follows:
General procedure: A mixture of aryl halide (0.5 mmol), potassium aryltrifluoroborate (0.6 mmol), K2CO3 (1.0 mmol), Pd/C (5%; 0.5 mol%), ethanol (3 mL), and distilled water (1 mL) was stirred at 80 °C in air for the time indicated. The reaction mixture was added to brine (15 mL) and extracted with ethyl acetate (4×15 mL). The organic solvent was removed under vacuum, and the product was isolated by short-column chromatography.
4'-Methyl-2-cyanobiphenyl synthesis

4'-Methyl-2-cyanobiphenyl ?? ?? ? ???

???

POTASSIUM 4-METHYLPHENYLTRIFLUOROBORATE 2-Bromobenzonitrile

?? ??

5-[4'-(Bromomethyl)-[1,1'-biphenyl]-2-yl]-2-(triphenylmethyl)-2H-tetrazole 4’-[(2-butyl-4-chloro-5-hydroxymethyl)-1H-imidazol-1-yl)methyl]-[1,1’-Biphenyl]-2-carbonitrile

4'-Methyl-2-cyanobiphenyl ?? ??

???( 654)?? ??
??? ?? ??? ?? ?? ? ??
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4'-Methyl-2-cyanobiphenyl ?? ??:

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