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1881331-98-1 | "[3-(1H-pyrrolo[2,3-b]pyridin-1-yl)propyl]amine dihydrochloride"
CAS No: 1881331-98-1 Catalog No: AG01FMJW MDL No:MFCD24387877
Product Description
Catalog Number:
AG01FMJW
Chemical Name:
"[3-(1H-pyrrolo[2,3-b]pyridin-1-yl)propyl]amine dihydrochloride"
CAS Number:
1881331-98-1
Molecular Formula:
C10H15Cl2N3
Molecular Weight:
248.1522
MDL Number:
MFCD24387877
IUPAC Name:
3-pyrrolo[2,3-b]pyridin-1-ylpropan-1-amine;dihydrochloride
InChI:
InChI=1S/C10H13N3.2ClH/c11-5-2-7-13-8-4-9-3-1-6-12-10(9)13;;/h1,3-4,6,8H,2,5,7,11H2;2*1H
InChI Key:
APWFYEUKGMDDQL-UHFFFAOYSA-N
SMILES:
NCCCn1ccc2c1nccc2.Cl.Cl
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
248.151g/mol
Monoisotopic Mass:
247.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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