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1196157-27-3 | 5H-Pyrrolo[3,2-d]pyrimidine, 2,4-dichloro-6-methyl-
CAS No: 1196157-27-3 Catalog No: AG000PDC MDL No:
Product Description
Catalog Number:
AG000PDC
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 2,4-dichloro-6-methyl-
CAS Number:
1196157-27-3
Molecular Formula:
C7H5Cl2N3
Molecular Weight:
202.0407
IUPAC Name:
2,4-dichloro-6-methyl-5H-pyrrolo[3,2-d]pyrimidine
InChI:
InChI=1S/C7H5Cl2N3/c1-3-2-4-5(10-3)6(8)12-7(9)11-4/h2,10H,1H3
InChI Key:
WXFDPWLIEMUJRE-UHFFFAOYSA-N
SMILES:
Clc1nc2cc([nH]c2c(n1)Cl)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.986g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.038g/mol
Monoisotopic Mass:
200.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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