Home Carboxys 4-Methoxy-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid

4-Methoxy-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid

CAS No.:
1523606-42-9
Catalog Number:
AG00HY0N
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
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Product Description
Catalog Number:
AG00HY0N
Chemical Name:
4-Methoxy-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid
CAS Number:
1523606-42-9
Molecular Formula:
C9H9N3O3
Molecular Weight:
207.1861
MDL Number:
MFCD27987045
IUPAC Name:
4-methoxy-7-methylpyrrolo[2,3-d]pyrimidine-6-carboxylic acid
InChI:
InChI=1S/C9H9N3O3/c1-12-6(9(13)14)3-5-7(12)10-4-11-8(5)15-2/h3-4H,1-2H3,(H,13,14)
InChI Key:
AQCBBZWIITWGGI-UHFFFAOYSA-N
SMILES:
COc1ncnc2c1cc(n2C)C(=O)O
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.064g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.189g/mol
Monoisotopic Mass:
207.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties