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Home Aminos 3-[(9H-Purin-6-ylamino)methyl]phenol

3-[(9H-Purin-6-ylamino)methyl]phenol

CAS No.:
75737-38-1
Catalog Number:
AG00G4K2
Molecular Formula:
C12H11N5O
Molecular Weight:
241.2486
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
98%
1 week
United States
$126
- +
100mg
98%
1 week
United States
$154
- +
500mg
98%
1 week
United States
$321
- +
Product Description
Catalog Number:
AG00G4K2
Chemical Name:
3-[(9H-Purin-6-ylamino)methyl]phenol
CAS Number:
75737-38-1
Molecular Formula:
C12H11N5O
Molecular Weight:
241.2486
MDL Number:
MFCD14155892
IUPAC Name:
3-[(7H-purin-6-ylamino)methyl]phenol
InChI:
InChI=1S/C12H11N5O/c18-9-3-1-2-8(4-9)5-13-11-10-12(15-6-14-10)17-7-16-11/h1-4,6-7,18H,5H2,(H2,13,14,15,16,17)
InChI Key:
BUDWTFCZGZYQHZ-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)CNc1ncnc2c1nc[nH]2
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
241.254g/mol
Monoisotopic Mass:
241.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Synthesis, characterization and biological activity of ring-substituted 6-benzylamino-9-tetrahydropyran-2-yl and 9-tetrahydrofuran-2-ylpurine derivatives. Bioorganic & medicinal chemistry 20090301
Properties