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Chemical ID: 7243647
Chemical ID:
7243647
Name [?]:
8-hydroxy-5-methyl-tetralin-1-one
SMILES [?]:
Cc1ccc(c2c1CCCC2=O)O
InChi [?]:
InChI=1/C11H12O2/c1-7-5-6-10(13)11-8(7)3-2-4-9(11)12/h5-6,13H,2-4H2,1H3
InChi Info:
AuxInfo=1/0/N:1,9,8,10,3,4,2,7,11,5,6,12,13/rA:13nCCCCCCCCCCCOO/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s6s10;d11;s5;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H12O2 |
All Atoms: | 25 |
Heavy Atoms: | 13 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 5.15211 |
Area: | 323.598 |
Solvation: | -2.93784 |
Coulombic: | -23.1935 |
Bond Count [?]
All: | 14 |
Single: | 10 |
Double: | 4 |
Rotors: | 0 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.14 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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