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114810-83-2 | Ethanol, 2-[(2-amino-7H-purin-7-yl)methoxy]-
CAS No: 114810-83-2 Catalog No: AG000FAO MDL No:
Product Description
Catalog Number:
AG000FAO
Chemical Name:
Ethanol, 2-[(2-amino-7H-purin-7-yl)methoxy]-
CAS Number:
114810-83-2
Molecular Formula:
C8H11N5O2
Molecular Weight:
209.2052
IUPAC Name:
2-[(2-aminopurin-7-yl)methoxy]ethanol
InChI:
InChI=1S/C8H11N5O2/c9-8-10-3-6-7(12-8)11-4-13(6)5-15-2-1-14/h3-4,14H,1-2,5H2,(H2,9,10,12)
InChI Key:
CNZFXDSUBCWQHC-UHFFFAOYSA-N
SMILES:
OCCOCn1cnc2c1cnc(n2)N
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.209g/mol
Monoisotopic Mass:
209.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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