Home Other Building Blocks 4-(Pyrimidin-2-yl)benzoic acid

4-(Pyrimidin-2-yl)benzoic acid

CAS No.:
199678-12-1
Catalog Number:
AG002C9L
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$50
- +
1g
97%
In Stock USA
United States
$138
- +
5g
97%
In Stock USA
United States
$525
- +
10g
97%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG002C9L
Chemical Name:
4-(Pyrimidin-2-yl)benzoic acid
CAS Number:
199678-12-1
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
MDL Number:
MFCD01318668
IUPAC Name:
4-pyrimidin-2-ylbenzoic acid
InChI:
InChI=1S/C11H8N2O2/c14-11(15)9-4-2-8(3-5-9)10-12-6-1-7-13-10/h1-7H,(H,14,15)
InChI Key:
WNDAEOTYLPWXPN-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1ncccn1
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.059g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.197g/mol
Monoisotopic Mass:
200.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties