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129872-82-8 | 5H-Pyrrolo[3,2-d]pyrimidine, 2,4-dichloro-5-ethyl-
CAS No: 129872-82-8 Catalog No: AG000TR3 MDL No:MFCD17013034
Product Description
Catalog Number:
AG000TR3
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 2,4-dichloro-5-ethyl-
CAS Number:
129872-82-8
Molecular Formula:
C8H7Cl2N3
Molecular Weight:
216.0673
MDL Number:
MFCD17013034
IUPAC Name:
2,4-dichloro-5-ethylpyrrolo[3,2-d]pyrimidine
InChI:
InChI=1S/C8H7Cl2N3/c1-2-13-4-3-5-6(13)7(9)12-8(10)11-5/h3-4H,2H2,1H3
InChI Key:
OMEALJXAHAGMIE-UHFFFAOYSA-N
SMILES:
CCn1ccc2c1c(Cl)nc(n2)Cl
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.002g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.065g/mol
Monoisotopic Mass:
215.002g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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