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Home Boronic acids 3-Chloro-4-(cyclopropylcarbamoyl)phenylboronic acid

3-Chloro-4-(cyclopropylcarbamoyl)phenylboronic acid

CAS No.:
850589-44-5
Catalog Number:
AG004S9H
Molecular Formula:
C10H11BClNO3
Molecular Weight:
239.4632
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$100
- +
1g
98%
In Stock USA
United States
$198
- +
5g
98%
In Stock USA
United States
$788
- +
Product Description
Catalog Number:
AG004S9H
Chemical Name:
3-Chloro-4-(cyclopropylcarbamoyl)phenylboronic acid
CAS Number:
850589-44-5
Molecular Formula:
C10H11BClNO3
Molecular Weight:
239.4632
MDL Number:
MFCD07363770
IUPAC Name:
[3-chloro-4-(cyclopropylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C10H11BClNO3/c12-9-5-6(11(15)16)1-4-8(9)10(14)13-7-2-3-7/h1,4-5,7,15-16H,2-3H2,(H,13,14)
InChI Key:
TUPWHDSMIIRKLY-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1Cl)B(O)O)NC1CC1
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.052g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
239.462g/mol
Monoisotopic Mass:
239.052g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties