200,000+ products from a single source!
sales@angenechem.com
17405-21-9 | 9H-Purine-6-carboxaldehyde
CAS No: 17405-21-9 Catalog No: AG001ZFD MDL No:
Product Description
Catalog Number:
AG001ZFD
Chemical Name:
9H-Purine-6-carboxaldehyde
CAS Number:
17405-21-9
Molecular Formula:
C6H4N4O
Molecular Weight:
148.1222
IUPAC Name:
7H-purine-6-carbaldehyde
InChI:
InChI=1S/C6H4N4O/c11-1-4-5-6(9-2-7-4)10-3-8-5/h1-3H,(H,7,8,9,10)
InChI Key:
NQFHKZPSNYOBIR-UHFFFAOYSA-N
SMILES:
O=Cc1ncnc2c1nc[nH]2
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.039g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.125g/mol
Monoisotopic Mass:
148.039g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.