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Home Boronic acids 3-(Tetrazol-5-yl)phenylboronic acid

3-(Tetrazol-5-yl)phenylboronic acid

CAS No.:
775351-30-9
Catalog Number:
AG008OW8
Molecular Formula:
C7H7BN4O2
Molecular Weight:
189.9671
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
In Stock USA
United States
$149
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5g
In Stock USA
United States
$615
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Product Description
Catalog Number:
AG008OW8
Chemical Name:
3-(Tetrazol-5-yl)phenylboronic acid
CAS Number:
775351-30-9
Molecular Formula:
C7H7BN4O2
Molecular Weight:
189.9671
MDL Number:
MFCD06739100
IUPAC Name:
[3-(2H-tetrazol-5-yl)phenyl]boronic acid
InChI:
InChI=1S/C7H7BN4O2/c13-8(14)6-3-1-2-5(4-6)7-9-11-12-10-7/h1-4,13-14H,(H,9,10,11,12)
InChI Key:
XMJKBDSKRITXBW-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)c1nnn[nH]1)O
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.066g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
189.969g/mol
Monoisotopic Mass:
190.066g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties