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100960-08-5 | 1H-Pyrrolo[2,3-b]pyridin-3-amine, hydrochloride (1:2)
CAS No: 100960-08-5 Catalog No: AG0003BN MDL No:MFCD11035725
Product Description
Catalog Number:
AG0003BN
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-3-amine, hydrochloride (1:2)
CAS Number:
100960-08-5
Molecular Formula:
C7H9Cl2N3
Molecular Weight:
206.0725
MDL Number:
MFCD11035725
IUPAC Name:
1H-pyrrolo[2,3-b]pyridin-3-amine;dihydrochloride
InChI:
InChI=1S/C7H7N3.2ClH/c8-6-4-10-7-5(6)2-1-3-9-7;;/h1-4H,8H2,(H,9,10);2*1H
InChI Key:
SJUROPXPIWYNFJ-UHFFFAOYSA-N
SMILES:
Nc1c[nH]c2c1cccn2.Cl.Cl
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.017g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
206.07g/mol
Monoisotopic Mass:
205.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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