Home Aldehydes 4-(Pyrimidin-5-yl)benzaldehyde

4-(Pyrimidin-5-yl)benzaldehyde

CAS No.:
198084-12-7
Catalog Number:
AG002B9Z
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$44
- +
5g
97%
In Stock USA
United States
$188
- +
25g
97%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG002B9Z
Chemical Name:
4-(Pyrimidin-5-yl)benzaldehyde
CAS Number:
198084-12-7
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
MDL Number:
MFCD02684108
IUPAC Name:
4-pyrimidin-5-ylbenzaldehyde
InChI:
InChI=1S/C11H8N2O/c14-7-9-1-3-10(4-2-9)11-5-12-8-13-6-11/h1-8H
InChI Key:
BXNXTOLXLPQMHS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1cncnc1
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.064g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties