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Chemical ID: 4665466
Chemical ID:
4665466
Name [?]:
1-methyl-4-styryl-benzene
SMILES [?]:
Cc1ccc(cc1)C=Cc2ccccc2
InChi [?]:
InChI=1/C15H14/c1-13-7-9-15(10-8-13)12-11-14-5-3-2-4-6-14/h2-12H,1H3
InChi Info:
AuxInfo=1/0/N:1,13,12,14,11,15,3,7,4,6,9,8,2,10,5/E:(3,4)(5,6)(7,8)(9,10)/rA:15nCCCCCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;s10;d11;s12;d13;d10s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H14 |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.39076 |
Area: | 369.137 |
Solvation: | -0.83765 |
Coulombic: | -4.55517 |
Bond Count [?]
All: | 16 |
Single: | 9 |
Double: | 7 |
Rotors: | 2 |
Chiral: | 1 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 194.272 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 5.09 |
LogP (Chemaxon): | 4.73 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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