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1373253-21-4 | 1H-Pyrrolo[2,3-b]pyridin-4-amine, acetate (1:1)
CAS No: 1373253-21-4 Catalog No: AG001353 MDL No:MFCD21608681
Product Description
Catalog Number:
AG001353
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-4-amine, acetate (1:1)
CAS Number:
1373253-21-4
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
MDL Number:
MFCD21608681
IUPAC Name:
acetic acid;1H-pyrrolo[2,3-b]pyridin-4-amine
InChI:
InChI=1S/C7H7N3.C2H4O2/c8-6-2-4-10-7-5(6)1-3-9-7;1-2(3)4/h1-4H,(H3,8,9,10);1H3,(H,3,4)
InChI Key:
DQXDMLNTPZMDBL-UHFFFAOYSA-N
SMILES:
Nc1ccnc2c1cc[nH]2.CC(=O)O
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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