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1111101-92-8 | 4-(2-Aminopyrimidin-5-yl)benzyl alcohol
CAS No: 1111101-92-8 Catalog No: AG01FC6A MDL No:
Product Description
Catalog Number:
AG01FC6A
Chemical Name:
4-(2-Aminopyrimidin-5-yl)benzyl alcohol
CAS Number:
1111101-92-8
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
IUPAC Name:
[4-(2-aminopyrimidin-5-yl)phenyl]methanol
InChI:
InChI=1S/C11H11N3O/c12-11-13-5-10(6-14-11)9-3-1-8(7-15)2-4-9/h1-6,15H,7H2,(H2,12,13,14)
InChI Key:
CIHQZTMOGZZDHD-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)c1cnc(nc1)N
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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