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Home > Aldehydes > 1369366-82-4
1369366-82-4 | 7H-Pyrrolo[2,3-d]pyrimidine-6-carboxaldehyde
CAS No: 1369366-82-4 Catalog No: AG0012KX MDL No:
Product Description
Catalog Number:
AG0012KX
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidine-6-carboxaldehyde
CAS Number:
1369366-82-4
Molecular Formula:
C7H5N3O
Molecular Weight:
147.1341
IUPAC Name:
7H-pyrrolo[2,3-d]pyrimidine-6-carbaldehyde
InChI:
InChI=1S/C7H5N3O/c11-3-6-1-5-2-8-4-9-7(5)10-6/h1-4H,(H,8,9,10)
InChI Key:
DYFTYQMQEVEDFD-UHFFFAOYSA-N
SMILES:
O=Cc1cc2c([nH]1)ncnc2
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.137g/mol
Monoisotopic Mass:
147.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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