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14052-83-6 | 7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 7-ethyl-
CAS No: 14052-83-6 Catalog No: AG001CJF MDL No:
Product Description
Catalog Number:
AG001CJF
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 7-ethyl-
CAS Number:
14052-83-6
Molecular Formula:
C8H10N4
Molecular Weight:
162.1918
IUPAC Name:
7-ethylpyrrolo[2,3-d]pyrimidin-4-amine
InChI:
InChI=1S/C8H10N4/c1-2-12-4-3-6-7(9)10-5-11-8(6)12/h3-5H,2H2,1H3,(H2,9,10,11)
InChI Key:
HBKRLOUTSJELJS-UHFFFAOYSA-N
SMILES:
CCn1ccc2c1ncnc2N
NSC Number:
106769
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.091g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.196g/mol
Monoisotopic Mass:
162.091g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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