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Home Boronic acids 4-(2-(Dimethylamino)ethylcarbamoyl)phenylboronic acid, HCl

4-(2-(Dimethylamino)ethylcarbamoyl)phenylboronic acid, HCl

CAS No.:
850568-22-8
Catalog Number:
AG004SI7
Molecular Formula:
C11H18BClN2O3
Molecular Weight:
272.5362
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG004SI7
Chemical Name:
4-(2-(Dimethylamino)ethylcarbamoyl)phenylboronic acid, HCl
CAS Number:
850568-22-8
Molecular Formula:
C11H18BClN2O3
Molecular Weight:
272.5362
MDL Number:
MFCD06656014
IUPAC Name:
[4-[2-(dimethylamino)ethylcarbamoyl]phenyl]boronic acid;hydrochloride
InChI:
InChI=1S/C11H17BN2O3.ClH/c1-14(2)8-7-13-11(15)9-3-5-10(6-4-9)12(16)17;/h3-6,16-17H,7-8H2,1-2H3,(H,13,15);1H
InChI Key:
UJXAREBBWZJMPR-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(=O)NCCN(C)C)O.Cl
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.11g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
272.536g/mol
Monoisotopic Mass:
272.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties