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116457-59-1 | 1,4,7,10-Tetrathiacyclotetradecane (9CI)
CAS No: 116457-59-1 Catalog No: AG000CK2 MDL No:
Product Description
Catalog Number:
AG000CK2
Chemical Name:
1,4,7,10-Tetrathiacyclotetradecane (9CI)
CAS Number:
116457-59-1
Molecular Formula:
C10H20S4
Molecular Weight:
268.5258
IUPAC Name:
1,4,7,10-tetrathiacyclotetradecane
InChI:
InChI=1S/C10H20S4/c1-2-4-12-6-8-14-10-9-13-7-5-11-3-1/h1-10H2
InChI Key:
ZGLWUPKSLVZGLE-UHFFFAOYSA-N
SMILES:
C1CCCSCCSCCSCCS1
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.51g/mol
Monoisotopic Mass:
268.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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