Home Other Building Blocks 1-(4-METHOXYPHENYL)-2-PYRIMIDIN-4-YLETHANONE

1-(4-METHOXYPHENYL)-2-PYRIMIDIN-4-YLETHANONE

CAS No.:
36827-95-9
Catalog Number:
AG00CAUK
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$94
- +
1g
1 week
United States
$149
- +
Product Description
Catalog Number:
AG00CAUK
Chemical Name:
1-(4-METHOXYPHENYL)-2-PYRIMIDIN-4-YLETHANONE
CAS Number:
36827-95-9
Molecular Formula:
C13H12N2O2
Molecular Weight:
228.2466
MDL Number:
MFCD04037915
IUPAC Name:
1-(4-methoxyphenyl)-2-pyrimidin-4-ylethanone
InChI:
InChI=1S/C13H12N2O2/c1-17-12-4-2-10(3-5-12)13(16)8-11-6-7-14-9-15-11/h2-7,9H,8H2,1H3
InChI Key:
ZRSLFIYDCIZOJX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)Cc1ccncn1
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.251g/mol
Monoisotopic Mass:
228.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties