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124738-81-4

124738-81-4 | 7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2-amino-4-chloro-

CAS No: 124738-81-4 Catalog No: AG000MP2 MDL No:MFCD11846506

Product Description

Catalog Number:
AG000MP2
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2-amino-4-chloro-
CAS Number:
124738-81-4
Molecular Formula:
C7H4ClN5
Molecular Weight:
193.5932
MDL Number:
MFCD11846506
IUPAC Name:
2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
InChI:
InChI=1S/C7H4ClN5/c8-5-4-3(1-9)2-11-6(4)13-7(10)12-5/h2H,(H3,10,11,12,13)
InChI Key:
VFKWCSCTCYYFAU-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]c2c1c(Cl)nc(n2)N

Properties

Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.016g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.594g/mol
Monoisotopic Mass:
193.016g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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