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Home Boronic acids 3-(Cyclohexylaminocarbonyl)phenylboronic acid

3-(Cyclohexylaminocarbonyl)phenylboronic acid

CAS No.:
850567-25-8
Catalog Number:
AG00G354
Molecular Formula:
C13H18BNO3
Molecular Weight:
247.0979
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$57
- +
25g
98%
In Stock USA
United States
$225
- +
100g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00G354
Chemical Name:
3-(Cyclohexylaminocarbonyl)phenylboronic acid
CAS Number:
850567-25-8
Molecular Formula:
C13H18BNO3
Molecular Weight:
247.0979
MDL Number:
MFCD04115696
IUPAC Name:
[3-(cyclohexylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C13H18BNO3/c16-13(15-12-7-2-1-3-8-12)10-5-4-6-11(9-10)14(17)18/h4-6,9,12,17-18H,1-3,7-8H2,(H,15,16)
InChI Key:
PZOTXXRWCKDMBC-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)B(O)O)NC1CCCCC1
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.138g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
247.101g/mol
Monoisotopic Mass:
247.138g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties