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Home Boronic acids 3-Chloro-4-(pyrrolidinyl-1-carbonyl)phenylboronic acid

3-Chloro-4-(pyrrolidinyl-1-carbonyl)phenylboronic acid

CAS No.:
850589-51-4
Catalog Number:
AG004YHN
Molecular Formula:
C11H13BClNO3
Molecular Weight:
253.4898
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$44
- +
250mg
95%
In Stock USA
United States
$82
- +
1g
95%
In Stock USA
United States
$164
- +
5g
95%
In Stock USA
United States
$788
- +
Product Description
Catalog Number:
AG004YHN
Chemical Name:
3-Chloro-4-(pyrrolidinyl-1-carbonyl)phenylboronic acid
CAS Number:
850589-51-4
Molecular Formula:
C11H13BClNO3
Molecular Weight:
253.4898
MDL Number:
MFCD07363776
IUPAC Name:
[3-chloro-4-(pyrrolidine-1-carbonyl)phenyl]boronic acid
InChI:
InChI=1S/C11H13BClNO3/c13-10-7-8(12(16)17)3-4-9(10)11(15)14-5-1-2-6-14/h3-4,7,16-17H,1-2,5-6H2
InChI Key:
YKSBQRHXLMQAEJ-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1C(=O)N1CCCC1)B(O)O
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.068g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.489g/mol
Monoisotopic Mass:
253.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties