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1140241-22-0 | 5H-Pyrrolo[3,2-d]pyrimidine, 2-chloro-4-methyl-
CAS No: 1140241-22-0 Catalog No: AG000ABL MDL No:MFCD11869950
Product Description
Catalog Number:
AG000ABL
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 2-chloro-4-methyl-
CAS Number:
1140241-22-0
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD11869950
IUPAC Name:
2-chloro-4-methyl-5H-pyrrolo[3,2-d]pyrimidine
InChI:
InChI=1S/C7H6ClN3/c1-4-6-5(2-3-9-6)11-7(8)10-4/h2-3,9H,1H3
InChI Key:
RJTAXXLTKRHRMI-UHFFFAOYSA-N
SMILES:
Clc1nc(C)c2c(n1)cc[nH]2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.596g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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