Home Boronic acids 4-(1-Azepanylmethyl)benzeneboronic acid pinacol ester

4-(1-Azepanylmethyl)benzeneboronic acid pinacol ester

CAS No.:
1315278-37-5
Catalog Number:
AG009YMA
Molecular Formula:
C19H30BNO2
Molecular Weight:
315.2580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$57
- +
1g
95%
In Stock USA
United States
$125
- +
5g
95%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG009YMA
Chemical Name:
4-(1-Azepanylmethyl)benzeneboronic acid pinacol ester
CAS Number:
1315278-37-5
Molecular Formula:
C19H30BNO2
Molecular Weight:
315.2580
MDL Number:
MFCD16294503
IUPAC Name:
1-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]azepane
InChI:
InChI=1S/C19H30BNO2/c1-18(2)19(3,4)23-20(22-18)17-11-9-16(10-12-17)15-21-13-7-5-6-8-14-21/h9-12H,5-8,13-15H2,1-4H3
InChI Key:
UFFAWIHINLIOPX-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(cc1)CN1CCCCCC1
Properties
Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.237g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.264g/mol
Monoisotopic Mass:
315.237g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties