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Home Boronic acids 3-(Cyclohexylaminocarbonyl)-5-nitrophenylboronic acid

3-(Cyclohexylaminocarbonyl)-5-nitrophenylboronic acid

CAS No.:
871332-85-3
Catalog Number:
AG004OSY
Molecular Formula:
C13H17BN2O5
Molecular Weight:
292.0955
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG004OSY
Chemical Name:
3-(Cyclohexylaminocarbonyl)-5-nitrophenylboronic acid
CAS Number:
871332-85-3
Molecular Formula:
C13H17BN2O5
Molecular Weight:
292.0955
MDL Number:
MFCD07783877
IUPAC Name:
[3-(cyclohexylcarbamoyl)-5-nitrophenyl]boronic acid
InChI:
InChI=1S/C13H17BN2O5/c17-13(15-11-4-2-1-3-5-11)9-6-10(14(18)19)8-12(7-9)16(20)21/h6-8,11,18-19H,1-5H2,(H,15,17)
InChI Key:
QWXJHAUEXFJACW-UHFFFAOYSA-N
SMILES:
OB(c1cc(cc(c1)[N+](=O)[O-])C(=O)NC1CCCCC1)O
Properties
Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.123g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
292.098g/mol
Monoisotopic Mass:
292.123g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties