Home Nitriles 1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarbonitrile

1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarbonitrile

CAS No.:
1346264-25-2
Catalog Number:
AG00HTCR
Molecular Formula:
C16H20BNO2
Molecular Weight:
269.1465
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Product Description
Catalog Number:
AG00HTCR
Chemical Name:
1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarbonitrile
CAS Number:
1346264-25-2
Molecular Formula:
C16H20BNO2
Molecular Weight:
269.1465
MDL Number:
MFCD19689506
IUPAC Name:
1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropane-1-carbonitrile
InChI:
InChI=1S/C16H20BNO2/c1-14(2)15(3,4)20-17(19-14)13-7-5-6-12(10-13)16(11-18)8-9-16/h5-7,10H,8-9H2,1-4H3
InChI Key:
PZSNJALXNOCBSV-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.159g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.151g/mol
Monoisotopic Mass:
269.159g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties