Home Aldehydes 2-Chloro-4-(methylamino)-5-pyrimidinecarboxaldehyde

2-Chloro-4-(methylamino)-5-pyrimidinecarboxaldehyde

CAS No.:
839708-50-8
Catalog Number:
AG00GLQW
Molecular Formula:
C6H6ClN3O
Molecular Weight:
171.5843
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$373
- +
1g
97%
1 week
United States
$644
- +
5g
97%
1 week
United States
$1856
- +
Product Description
Catalog Number:
AG00GLQW
Chemical Name:
2-Chloro-4-(methylamino)-5-pyrimidinecarboxaldehyde
CAS Number:
839708-50-8
Molecular Formula:
C6H6ClN3O
Molecular Weight:
171.5843
MDL Number:
MFCD20685758
IUPAC Name:
2-chloro-4-(methylamino)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C6H6ClN3O/c1-8-5-4(3-11)2-9-6(7)10-5/h2-3H,1H3,(H,8,9,10)
InChI Key:
XJYGRFRPWJCWEF-UHFFFAOYSA-N
SMILES:
CNc1nc(Cl)ncc1C=O
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.584g/mol
Monoisotopic Mass:
171.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties