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137044-24-7 | 1-Octadecanaminium, N,N,N-trioctadecyl-, hydroxide (1:1)
CAS No: 137044-24-7 Catalog No: AG0012RV MDL No:
Product Description
Catalog Number:
AG0012RV
Chemical Name:
1-Octadecanaminium, N,N,N-trioctadecyl-, hydroxide (1:1)
CAS Number:
137044-24-7
Molecular Formula:
C72H149NO
Molecular Weight:
1044.9596
IUPAC Name:
tetraoctadecylazanium;hydroxide
InChI:
InChI=1S/C72H148N.H2O/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-69-73(70-66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,71-67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)72-68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4;/h5-72H2,1-4H3;1H2/q+1;/p-1
InChI Key:
HNRXDBMBQAOWFV-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC.[OH-]
Properties
Complexity:
775
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1044.164g/mol
Formal Charge:
0
Heavy Atom Count:
74
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
1044.99g/mol
Monoisotopic Mass:
1044.164g/mol
Rotatable Bond Count:
68
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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