4-CYANOPHENYLBORONIC ACID

CAS No.
126747-14-6
CCD No.
CCD00212176
Formula
C7 H6 B N O2
MolWeight
146.94

Basic Information

Product Name: 4-CYANOPHENYLBORONIC ACID
CAS: 126747-14-6
English Synonyms: 4-CYANOPHENYLBORONIC ACID ; BORONIC ACID, (4-CYANOPHENYL)- ; 4-BORONOBENZONITRILE ; BORONIC ACID, B-(4-CYANOPHENYL)- ; (4-CYANOPHENYL)BORONIC ACID ; (P-CYANOPHENYL)BORONIC ACID ; 4-(DIHYDROXYBORANYL)BENZONITRILE ; 4-CYANOBENZENEBORONIC ACID ; 4-CYANOPHENYLBORIC ACID
MDL Number.: MFCD01318968
H bond acceptor: 3
H bond donor: 2
Smile: B(c1ccc(cc1)C#N)(O)O
InChi: InChI=1S/C7H6BNO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,10-11H
InChiKey: InChIKey=CEBAHYWORUOILU-UHFFFAOYSA-N

Property

Melting Point: >350 DEG C(LIT)/>350 °C
Comments: APPLICATION: REACTANT INVOLVED IN: OXIDATIVE HYDROXYLATION. TRIFLUOROMETHYLATION. 1,4-ADDITION REACTIONS. PRECURSOR IN THE SYNTHESIS OF INHIBITORS SUCH AS: TPL2 KINASE INHIBITORS. P2X7 ANTAGONISTS USED IN THE TREATMENT OF PAIN
OTHER NOTES: CONTAINS VARYING AMOUNTS OF ANHYDRIDE
UNSPSC: 12352103
WGK: 3

Safety information

UN Code: 2811
WGK Germany: 3

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