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1375303-26-6 | 5H-Pyrrolo[3,2-d]pyrimidine, 2,4-dichloro-5-(2-propen-1-yl)-
CAS No: 1375303-26-6 Catalog No: AG0013IC MDL No:
Product Description
Catalog Number:
AG0013IC
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 2,4-dichloro-5-(2-propen-1-yl)-
CAS Number:
1375303-26-6
Molecular Formula:
C9H7Cl2N3
Molecular Weight:
228.0780
IUPAC Name:
2,4-dichloro-5-prop-2-enylpyrrolo[3,2-d]pyrimidine
InChI:
InChI=1S/C9H7Cl2N3/c1-2-4-14-5-3-6-7(14)8(10)13-9(11)12-6/h2-3,5H,1,4H2
InChI Key:
JUAZIHNJVOYOTK-UHFFFAOYSA-N
SMILES:
C=CCn1ccc2c1c(Cl)nc(n2)Cl
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.002g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.076g/mol
Monoisotopic Mass:
227.002g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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