Chemical ID: 7228404

CC1CCC(C1)(C(=O)[O-])[NH3+]
Chemical ID:
7228404
Name [?]:
1-azaniumyl-3-methyl-cyclopentane-1-carboxylate
SMILES [?]:
CC1CCC(C1)(C(=O)[O-])[NH3+]
InChi [?]:
InChI=1/C7H13NO2/c1-5-2-3-7(8,4-5)6(9)10/h5H,2-4,8H2,1H3,(H,9,10)
InChi Info:
AuxInfo=1/1/N:1,3,4,6,2,7,5,10,8,9/E:(9,10)/rA:10cCCCCCCCOO-N+/rB:s1;s2;s3;s4;s2s5;s5;d7;s7;s5;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H13NO2
All Atoms:23
Heavy Atoms:10
Chiral Atoms:None
ZAP Information [?]
Total:-28.4985
Area:295.2
Solvation:-35.8785
Coulombic:-5.71386
Bond Count [?]
All:10
Single:9
Double:1
Rotors:1
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:-0.14
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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