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182-12-7

182-12-7 | 7,8,15,16,17-Pentathiadispiro[5.2.5.3]heptadecane (6CI,7CI,8CI,9CI)

CAS No: 182-12-7 Catalog No: AG00239Z MDL No:

Product Description

Catalog Number:
AG00239Z
Chemical Name:
7,8,15,16,17-Pentathiadispiro[5.2.5.3]heptadecane (6CI,7CI,8CI,9CI)
CAS Number:
182-12-7
Molecular Formula:
C12H20S5
Molecular Weight:
324.6122
IUPAC Name:
7,8,15,16,17-pentathiadispiro[5.2.59.36]heptadecane
InChI:
InChI=1S/C12H20S5/c1-3-7-11(8-4-1)13-14-12(16-17-15-11)9-5-2-6-10-12/h1-10H2
InChI Key:
JXSFXRAOCCMUMJ-UHFFFAOYSA-N
SMILES:
C1CCC2(CC1)SSSC1(SS2)CCCCC1
UNII:
49L2RW6YD4
NSC Number:
67640

Properties

Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.017g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.592g/mol
Monoisotopic Mass:
324.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  

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