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28841-49-8 | 1-Propanaminium, 3-amino-N,N,N-trimethyl-, bromide (1:1)
CAS No: 28841-49-8 Catalog No: AG002WT6 MDL No:
Product Description
Catalog Number:
AG002WT6
Chemical Name:
1-Propanaminium, 3-amino-N,N,N-trimethyl-, bromide (1:1)
CAS Number:
28841-49-8
Molecular Formula:
C6H17BrN2
Molecular Weight:
197.1166
IUPAC Name:
3-aminopropyl(trimethyl)azanium;bromide
InChI:
InChI=1S/C6H17N2.BrH/c1-8(2,3)6-4-5-7;/h4-7H2,1-3H3;1H/q+1;/p-1
InChI Key:
RBRKJNDIJJTXAW-UHFFFAOYSA-M
SMILES:
NCCC[N+](C)(C)C.[Br-]
Properties
Complexity:
54
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.058g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.12g/mol
Monoisotopic Mass:
196.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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