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Chemical ID: 6497750
Chemical ID:
6497750
Name [?]:
7-methyl-1-vinyl-4,5,6,7-tetrahydroindole
SMILES [?]:
CC1CCCc2c1n(cc2)C=C
InChi [?]:
InChI=1/C11H15N/c1-3-12-8-7-10-6-4-5-9(2)11(10)12/h3,7-9H,1,4-6H2,2H3
InChi Info:
AuxInfo=1/0/N:12,1,11,4,3,5,10,9,2,6,7,8/rA:12cCCCCCCCNCCCC/rB:s1;s2;s3;s4;s5;s2d6;s7;s8;s6d9;s8;d11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H15N |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 7.02118 |
Area: | 320.929 |
Solvation: | -1.00204 |
Coulombic: | -6.25188 |
Bond Count [?]
All: | 13 |
Single: | 10 |
Double: | 3 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 161.244 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 2.63 |
LogP (Chemaxon): | 3.14 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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