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Chemical ID: 6682516
Chemical ID:
6682516
Name [?]:
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
SMILES [?]:
CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C
InChi [?]:
InChI=1/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h15-18,23-24H,9-14,19-22H2,1-8H3
InChi Info:
AuxInfo=1/0/N:1,30,26,27,28,16,29,21,12,13,4,23,8,18,3,24,11,14,5,22,9,17,7,19,2,25,10,15,6,20/E:(1,2,3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(29,30)/rA:30nCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/rB:s1;d2;s3;s4;s5;w6;s7;s8;s9;w10;s11;s12;s13;w14;s15;s15;s17;s18;w19;s20;s20;s22;s23;d24;s25;s25;s10;s6;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C30H50 |
All Atoms: | 30 |
Heavy Atoms: | 30 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 18.9816 |
Area: | 793.027 |
Solvation: | -0.844063 |
Coulombic: | -8.38785 |
Bond Count [?]
All: | 29 |
Single: | 23 |
Double: | 6 |
Rotors: | 15 |
Chiral: | 4 |
Rigid Segments: | 11 |
Chemical Properties
Molecular Weight: | 410.718 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 8.32 |
LogP (Chemaxon): | 9.37 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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Chemical Mix | Source | External ID | Descriptor | Value |
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