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Home Halogens Ethyl 2-amino-4-chlorothieno[2,3-d]pyrimidine-6-carboxylate

Ethyl 2-amino-4-chlorothieno[2,3-d]pyrimidine-6-carboxylate

CAS No.:
847560-46-7
Catalog Number:
AG004RW1
Molecular Formula:
C9H8ClN3O2S
Molecular Weight:
257.6967
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Product Description
Catalog Number:
AG004RW1
Chemical Name:
Ethyl 2-amino-4-chlorothieno[2,3-d]pyrimidine-6-carboxylate
CAS Number:
847560-46-7
Molecular Formula:
C9H8ClN3O2S
Molecular Weight:
257.6967
MDL Number:
MFCD18074287
IUPAC Name:
ethyl 2-amino-4-chlorothieno[2,3-d]pyrimidine-6-carboxylate
InChI:
InChI=1S/C9H8ClN3O2S/c1-2-15-8(14)5-3-4-6(10)12-9(11)13-7(4)16-5/h3H,2H2,1H3,(H2,11,12,13)
InChI Key:
RVSQDXBPGDMBIQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1sc2c(c1)c(Cl)nc(n2)N
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.003g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.692g/mol
Monoisotopic Mass:
257.003g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties