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80235-02-5 | 1H-Pyrrolo[2,3-b]pyridin-2-amine
CAS No: 80235-02-5 Catalog No: AG005C9Q MDL No:MFCD13175768
Product Description
Catalog Number:
AG005C9Q
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-2-amine
CAS Number:
80235-02-5
Molecular Formula:
C7H7N3
Molecular Weight:
133.1506
MDL Number:
MFCD13175768
IUPAC Name:
1H-pyrrolo[2,3-b]pyridin-2-amine
InChI:
InChI=1S/C7H7N3/c8-6-4-5-2-1-3-9-7(5)10-6/h1-4H,8H2,(H,9,10)
InChI Key:
CUYRVEQRBOMISE-UHFFFAOYSA-N
SMILES:
Nc1cc2c([nH]1)nccc2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
133.154g/mol
Monoisotopic Mass:
133.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Electronic spectra of 7-azaindole/ammonia clusters and their photochemical reactivity. | The Journal of chemical physics 20080914 |
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