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74440-81-6 | N-Hexylpyridinium Bromide
CAS No: 74440-81-6 Catalog No: AG0036LK MDL No:MFCD03427613
Product Description
Catalog Number:
AG0036LK
Chemical Name:
N-Hexylpyridinium Bromide
CAS Number:
74440-81-6
Molecular Formula:
C11H18BrN
Molecular Weight:
244.1713
MDL Number:
MFCD03427613
IUPAC Name:
1-hexylpyridin-1-ium;bromide
InChI:
InChI=1S/C11H18N.BrH/c1-2-3-4-6-9-12-10-7-5-8-11-12;/h5,7-8,10-11H,2-4,6,9H2,1H3;1H/q+1;/p-1
InChI Key:
SZRSEFNUSHACPD-UHFFFAOYSA-M
SMILES:
CCCCCC[n+]1ccccc1.[Br-]
Properties
Complexity:
95.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.062g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.176g/mol
Monoisotopic Mass:
243.062g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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