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129034-91-9 | 1,4,8,11-Tetrathiacyclotetradecane, 6,6-dimethyl-
CAS No: 129034-91-9 Catalog No: AG000YSM MDL No:
Product Description
Catalog Number:
AG000YSM
Chemical Name:
1,4,8,11-Tetrathiacyclotetradecane, 6,6-dimethyl-
CAS Number:
129034-91-9
Molecular Formula:
C12H24S4
Molecular Weight:
296.5790
IUPAC Name:
6,6-dimethyl-1,4,8,11-tetrathiacyclotetradecane
InChI:
InChI=1S/C12H24S4/c1-12(2)10-15-8-6-13-4-3-5-14-7-9-16-11-12/h3-11H2,1-2H3
InChI Key:
CNPTVAWQVKRQNK-UHFFFAOYSA-N
SMILES:
CC1(C)CSCCSCCCSCCSC1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.076g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.564g/mol
Monoisotopic Mass:
296.076g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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