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Home Boronic acids 4-(2-Nitroethyl)phenylboronic acid

4-(2-Nitroethyl)phenylboronic acid

CAS No.:
957034-36-5
Catalog Number:
AG003BTZ
Molecular Formula:
C8H10BNO4
Molecular Weight:
194.9803
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$200
- +
1g
96%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG003BTZ
Chemical Name:
4-(2-Nitroethyl)phenylboronic acid
CAS Number:
957034-36-5
Molecular Formula:
C8H10BNO4
Molecular Weight:
194.9803
MDL Number:
MFCD09258738
IUPAC Name:
[4-(2-nitroethyl)phenyl]boronic acid
InChI:
InChI=1S/C8H10BNO4/c11-9(12)8-3-1-7(2-4-8)5-6-10(13)14/h1-4,11-12H,5-6H2
InChI Key:
AJJHOWDNLQDXKT-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)CC[N+](=O)[O-])O
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.07g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.981g/mol
Monoisotopic Mass:
195.07g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties