200,000+ products from a single source!
sales@angenechem.com
123752-07-8 | 7H-Purine-7-butanal, 2-amino-1,6-dihydro-6-oxo-
CAS No: 123752-07-8 Catalog No: AG000L20 MDL No:
Product Description
Catalog Number:
AG000L20
Chemical Name:
7H-Purine-7-butanal, 2-amino-1,6-dihydro-6-oxo-
CAS Number:
123752-07-8
Molecular Formula:
C9H11N5O2
Molecular Weight:
221.2159
IUPAC Name:
4-(2-amino-6-oxo-1H-purin-7-yl)butanal
InChI:
InChI=1S/C9H11N5O2/c10-9-12-7-6(8(16)13-9)14(5-11-7)3-1-2-4-15/h4-5H,1-3H2,(H3,10,12,13,16)
InChI Key:
FRBHAZWTNAYCJI-UHFFFAOYSA-N
SMILES:
O=CCCCn1cnc2c1c(=O)[nH]c(n2)N
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.091g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.22g/mol
Monoisotopic Mass:
221.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.