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Chemical ID: 7242172
Chemical ID:
7242172
Name [?]:
(5-azaniumyl-5-carboxy-pentyl)ammonium
SMILES [?]:
C(CC[NH3+])CC(C(=O)O)[NH3+]
InChi [?]:
InChI=1/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/p+2
InChi Info:
AuxInfo=1/1/N:1,2,5,3,6,7,4,10,8,9/E:(9,10)/rA:10cCCCN+CCCOON+/rB:s1;s2;s3;s1;s5;s6;d7;s7;s6;/rC:;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C6H16N2O2+2 |
All Atoms: | 26 |
Heavy Atoms: | 10 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | -97.622 |
Area: | 331.011 |
Solvation: | -105.897 |
Coulombic: | 88.9222 |
Bond Count [?]
All: | 9 |
Single: | 8 |
Double: | 1 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | -2.95 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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