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26281-56-1 | 1-Propanaminium, 3,3'-dithiobis[N,N,N-trimethyl- (9CI)
CAS No: 26281-56-1 Catalog No: AG002SKD MDL No:
Product Description
Catalog Number:
AG002SKD
Chemical Name:
1-Propanaminium, 3,3'-dithiobis[N,N,N-trimethyl- (9CI)
CAS Number:
26281-56-1
Molecular Formula:
C12H30N2S2++
Molecular Weight:
266.5100
IUPAC Name:
trimethyl-[3-[3-(trimethylazaniumyl)propyldisulfanyl]propyl]azanium
InChI:
InChI=1S/C12H30N2S2/c1-13(2,3)9-7-11-15-16-12-8-10-14(4,5)6/h7-12H2,1-6H3/q+2
InChI Key:
JYOAKKNXFYVCTJ-UHFFFAOYSA-N
SMILES:
C[N+](CCCSSCCC[N+](C)(C)C)(C)C
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.185g/mol
Formal Charge:
2
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.506g/mol
Monoisotopic Mass:
266.185g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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