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1391497-54-3 | 3-Pyridinemethanamine, 5-bromo-α-methyl-, hydrochloride (1:1), (αS)-
CAS No: 1391497-54-3 Catalog No: AG001AEB MDL No:MFCD12759951
Product Description
Catalog Number:
AG001AEB
Chemical Name:
3-Pyridinemethanamine, 5-bromo-α-methyl-, hydrochloride (1:1), (αS)-
CAS Number:
1391497-54-3
Molecular Formula:
C7H10BrClN2
Molecular Weight:
237.5247
MDL Number:
MFCD12759951
IUPAC Name:
(1S)-1-(5-bromopyridin-3-yl)ethanamine;hydrochloride
InChI:
InChI=1S/C7H9BrN2.ClH/c1-5(9)6-2-7(8)4-10-3-6;/h2-5H,9H2,1H3;1H/t5-;/m0./s1
InChI Key:
QZTWVVOMUCTRSJ-JEDNCBNOSA-N
SMILES:
C[C@@H](c1cc(Br)cnc1)N.Cl
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
235.972g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
237.525g/mol
Monoisotopic Mass:
235.972g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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