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16372-08-0 | 5H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-6,7-dihydro-
CAS No: 16372-08-0 Catalog No: AG001UCY MDL No:MFCD11518925
Product Description
Catalog Number:
AG001UCY
Chemical Name:
5H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-6,7-dihydro-
CAS Number:
16372-08-0
Molecular Formula:
C6H6ClN3
Molecular Weight:
155.5849
MDL Number:
MFCD11518925
IUPAC Name:
4-chloro-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine
InChI:
InChI=1S/C6H6ClN3/c7-5-4-1-2-8-6(4)10-3-9-5/h3H,1-2H2,(H,8,9,10)
InChI Key:
LJXVPXRXXVHTBP-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1CCN2
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.585g/mol
Monoisotopic Mass:
155.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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