Home Boronic acids 4-[2-(N,N-Diethylaminoethyl)aminocarbonyl]phenylboronic acid, HCl

4-[2-(N,N-Diethylaminoethyl)aminocarbonyl]phenylboronic acid, HCl

CAS No.:
913835-46-8
Catalog Number:
AG006BHT
Molecular Formula:
C13H22BClN2O3
Molecular Weight:
300.5894
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$86
- +
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
25g
98%
In Stock USA
United States
$975
- +
Product Description
Catalog Number:
AG006BHT
Chemical Name:
4-[2-(N,N-Diethylaminoethyl)aminocarbonyl]phenylboronic acid, HCl
CAS Number:
913835-46-8
Molecular Formula:
C13H22BClN2O3
Molecular Weight:
300.5894
MDL Number:
MFCD09027220
IUPAC Name:
[4-[2-(diethylamino)ethylcarbamoyl]phenyl]boronic acid;hydrochloride
InChI:
InChI=1S/C13H21BN2O3.ClH/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(8-6-11)14(18)19;/h5-8,18-19H,3-4,9-10H2,1-2H3,(H,15,17);1H
InChI Key:
WQYCSVUEHAFRHV-UHFFFAOYSA-N
SMILES:
CCN(CCNC(=O)c1ccc(cc1)B(O)O)CC.Cl
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.141g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
300.59g/mol
Monoisotopic Mass:
300.141g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties