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13028-68-7 | 1-Propanaminium, N,N,N-triethyl-, bromide (1:1)
CAS No: 13028-68-7 Catalog No: AG000U7H MDL No:
Product Description
Catalog Number:
AG000U7H
Chemical Name:
1-Propanaminium, N,N,N-triethyl-, bromide (1:1)
CAS Number:
13028-68-7
Molecular Formula:
C9H22BrN
Molecular Weight:
224.1817
IUPAC Name:
triethyl(propyl)azanium;bromide
InChI:
InChI=1S/C9H22N.BrH/c1-5-9-10(6-2,7-3)8-4;/h5-9H2,1-4H3;1H/q+1;/p-1
InChI Key:
AEFDTACAGGUGSB-UHFFFAOYSA-M
SMILES:
CCC[N+](CC)(CC)CC.[Br-]
Properties
Complexity:
66.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.094g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.186g/mol
Monoisotopic Mass:
223.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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