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1379367-43-7 | 7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2,4-dichloro-
CAS No: 1379367-43-7 Catalog No: AG0017OW MDL No:MFCD12828241
Product Description
Catalog Number:
AG0017OW
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2,4-dichloro-
CAS Number:
1379367-43-7
Molecular Formula:
C7H2Cl2N4
Molecular Weight:
213.0236
MDL Number:
MFCD12828241
IUPAC Name:
2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
InChI:
InChI=1S/C7H2Cl2N4/c8-5-4-3(1-10)2-11-6(4)13-7(9)12-5/h2H,(H,11,12,13)
InChI Key:
PTJZAFFKLILORJ-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]c2c1c(Cl)nc(n2)Cl
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.966g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.021g/mol
Monoisotopic Mass:
211.966g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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