Home Nitriles 2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isonicotinonitrile

2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isonicotinonitrile

CAS No.:
944401-73-4
Catalog Number:
AG00II6A
Molecular Formula:
C12H16BN3O2
Molecular Weight:
245.0853
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$489
- +
1g
95%
1 week
United States
$1169
- +
Product Description
Catalog Number:
AG00II6A
Chemical Name:
2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isonicotinonitrile
CAS Number:
944401-73-4
Molecular Formula:
C12H16BN3O2
Molecular Weight:
245.0853
MDL Number:
MFCD12923419
IUPAC Name:
2-amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-4-carbonitrile
InChI:
InChI=1S/C12H16BN3O2/c1-11(2)12(3,4)18-13(17-11)9-7-16-10(15)5-8(9)6-14/h5,7H,1-4H3,(H2,15,16)
InChI Key:
ILFHCZIKOMNCGU-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)ncc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
361  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.134g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.089g/mol
Monoisotopic Mass:
245.134g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties