Home Halogens Ethyl 4-chloro-5h-pyrrolo[3,2-d]pyrimidine-7-carboxylate

Ethyl 4-chloro-5h-pyrrolo[3,2-d]pyrimidine-7-carboxylate

CAS No.:
853058-42-1
Catalog Number:
AG004LP2
Molecular Formula:
C9H8ClN3O2
Molecular Weight:
225.6317
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$260
- +
1g
97%
1 week
United States
$414
- +
5g
97%
1 week
United States
$1237
- +
10g
97%
1 week
United States
$1921
- +
Product Description
Catalog Number:
AG004LP2
Chemical Name:
Ethyl 4-chloro-5h-pyrrolo[3,2-d]pyrimidine-7-carboxylate
CAS Number:
853058-42-1
Molecular Formula:
C9H8ClN3O2
Molecular Weight:
225.6317
MDL Number:
MFCD10566079
IUPAC Name:
ethyl 4-chloro-5H-pyrrolo[3,2-d]pyrimidine-7-carboxylate
InChI:
InChI=1S/C9H8ClN3O2/c1-2-15-9(14)5-3-11-7-6(5)12-4-13-8(7)10/h3-4,11H,2H2,1H3
InChI Key:
RJYXGAURZSGDON-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c[nH]c2c1ncnc2Cl
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.632g/mol
Monoisotopic Mass:
225.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties