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4649-09-6 | 7-Azaindole-3-Carboxaldehyde
CAS No: 4649-09-6 Catalog No: AG00328E MDL No:MFCD03407363
Product Description
Catalog Number:
AG00328E
Chemical Name:
7-Azaindole-3-Carboxaldehyde
CAS Number:
4649-09-6
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
MDL Number:
MFCD03407363
IUPAC Name:
1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C8H6N2O/c11-5-6-4-10-8-7(6)2-1-3-9-8/h1-5H,(H,9,10)
InChI Key:
KAIWRKYDYWYFIT-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1cccn2
NSC Number:
173969
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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