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Chemical ID: 7232064
Chemical ID:
7232064
Name [?]:
2-[1-(acetamidomethyl)cyclohexyl]acetic acid
SMILES [?]:
CC(=O)NCC1(CCCCC1)CC(=O)O
InChi [?]:
InChI=1/C11H19NO3/c1-9(13)12-8-11(7-10(14)15)5-3-2-4-6-11/h2-8H2,1H3,(H,12,13)(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,9,8,10,7,11,12,5,2,13,6,4,3,14,15/E:(3,4)(5,6)(14,15)/rA:15nCCONCCCCCCCCCOO/rB:s1;d2;s2;s4;s5;s6;s7;s8;s9;s6s10;s6;s12;d13;s13;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H19NO3 |
All Atoms: | 34 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 6.7261 |
Area: | 388.342 |
Solvation: | -2.98244 |
Coulombic: | -45.6763 |
Bond Count [?]
All: | 15 |
Single: | 13 |
Double: | 2 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 1.67 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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