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19004-42-3 | 2-Pyridinemethanaminium, N,N,N-trimethyl-, bromide, hydrobromide (1:1:1)
CAS No: 19004-42-3 Catalog No: AG002E9M MDL No:
Product Description
Catalog Number:
AG002E9M
Chemical Name:
2-Pyridinemethanaminium, N,N,N-trimethyl-, bromide, hydrobromide (1:1:1)
CAS Number:
19004-42-3
Molecular Formula:
C9H16Br2N2
Molecular Weight:
312.0447
IUPAC Name:
trimethyl(pyridin-2-ylmethyl)azanium;bromide
InChI:
InChI=1S/C9H15N2.BrH/c1-11(2,3)8-9-6-4-5-7-10-9;/h4-7H,8H2,1-3H3;1H/q+1;/p-1
InChI Key:
QLFUAMKECWUKTK-UHFFFAOYSA-M
SMILES:
C[N+](Cc1ccccn1)(C)C.Br.[Br-]
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.137g/mol
Monoisotopic Mass:
230.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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