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Chemical ID: 6128753
Chemical ID:
6128753
Name [?]:
methyl 4-aminocyclohexane-1-carboxylate
SMILES [?]:
COC(=O)C1CCC(CC1)N
InChi [?]:
InChI=1/C8H15NO2/c1-11-8(10)6-2-4-7(9)5-3-6/h6-7H,2-5,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,6,10,7,9,5,8,3,11,4,2/E:(2,3)(4,5)/rA:11nCOCOCCCCCCN/rB:s1;s2;d3;s3;s5;s6;s7;s8;s5s9;s8;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C8H15NO2 |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.21956 |
Area: | 322.969 |
Solvation: | -1.85467 |
Coulombic: | -30.4951 |
Bond Count [?]
All: | 11 |
Single: | 10 |
Double: | 1 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 157.21 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 0.42 |
LogP (Chemaxon): | 0.33 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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