Home Other Building Blocks 6-Chloro-4(1h)-pyrimidinone

6-Chloro-4(1h)-pyrimidinone

CAS No.:
4765-77-9
Catalog Number:
AG0037TP
Molecular Formula:
C4H3ClN2O
Molecular Weight:
130.5324
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$24
- +
5g
95%
In Stock USA
United States
$57
- +
10g
98%
In Stock USA
United States
$100
- +
25g
98%
In Stock USA
United States
$182
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG0037TP
Chemical Name:
6-Chloro-4(1h)-pyrimidinone
CAS Number:
4765-77-9
Molecular Formula:
C4H3ClN2O
Molecular Weight:
130.5324
MDL Number:
MFCD00233957
IUPAC Name:
4-chloro-1H-pyrimidin-6-one
InChI:
InChI=1S/C4H3ClN2O/c5-3-1-4(8)7-2-6-3/h1-2H,(H,6,7,8)
InChI Key:
AXFABVAPHSWFMD-UHFFFAOYSA-N
SMILES:
O=c1nc[nH]c(c1)Cl
NSC Number:
618279
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.993g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
130.531g/mol
Monoisotopic Mass:
129.993g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
1,4-Bis(6-chloro-pyrimidin-4-yl-oxy)benzene. Acta crystallographica. Section E, Structure reports online 20090201
Properties