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Home Boronic acids 4-((Tetrahydrofuran-2-yl)methylcarbamoyl)phenylboronic acid

4-((Tetrahydrofuran-2-yl)methylcarbamoyl)phenylboronic acid

CAS No.:
874534-61-9
Catalog Number:
AG003BTS
Molecular Formula:
C12H16BNO4
Molecular Weight:
249.0707
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$51
- +
1g
98%
In Stock USA
United States
$82
- +
5g
98%
In Stock USA
United States
$282
- +
Product Description
Catalog Number:
AG003BTS
Chemical Name:
4-((Tetrahydrofuran-2-yl)methylcarbamoyl)phenylboronic acid
CAS Number:
874534-61-9
Molecular Formula:
C12H16BNO4
Molecular Weight:
249.0707
MDL Number:
MFCD12025995
IUPAC Name:
[4-(oxolan-2-ylmethylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C12H16BNO4/c15-12(14-8-11-2-1-7-18-11)9-3-5-10(6-4-9)13(16)17/h3-6,11,16-17H,1-2,7-8H2,(H,14,15)
InChI Key:
BAQWKOHCDPHSRV-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)B(O)O)NCC1CCCO1
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.117g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
249.073g/mol
Monoisotopic Mass:
249.117g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties