Home Other Building Blocks 6-HYDROXY-2-METHOXY-7-DEAZAPURINE

6-HYDROXY-2-METHOXY-7-DEAZAPURINE

CAS No.:
90057-07-1
Catalog Number:
AG00GWA0
Molecular Formula:
C7H7N3O2
Molecular Weight:
165.1494
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Product Description
Catalog Number:
AG00GWA0
Chemical Name:
6-HYDROXY-2-METHOXY-7-DEAZAPURINE
CAS Number:
90057-07-1
Molecular Formula:
C7H7N3O2
Molecular Weight:
165.1494
MDL Number:
MFCD04039558
IUPAC Name:
2-methoxy-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C7H7N3O2/c1-12-7-9-5-4(2-3-8-5)6(11)10-7/h2-3H,1H3,(H2,8,9,10,11)
InChI Key:
VBKWGPQGJOITCT-UHFFFAOYSA-N
SMILES:
COc1[nH]c(=O)c2c(n1)[nH]cc2
NSC Number:
622774
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.054g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.152g/mol
Monoisotopic Mass:
165.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties