Chemical ID: 7242545

C(CC(C(=O)O)[NH3+])CNC(=[NH2+])N
Chemical ID:
7242545
Name [?]:
[4-(amino-azaniumylidene-methyl)amino-1-carboxy-butyl]ammonium
SMILES [?]:
C(CC(C(=O)O)[NH3+])CNC(=[NH2+])N
InChi [?]:
InChI=1/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/p+2
InChi Info:
AuxInfo=1/1/N:1,2,8,3,4,10,7,11,12,9,5,6/E:(8,9)(11,12)/rA:12cCCCCOON+CNCN+N/rB:s1;s2;s3;d4;s4;s3;s1;s8;s9;d10;s10;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H16N4O2+2
All Atoms:28
Heavy Atoms:12
Chiral Atoms:None
ZAP Information [?]
Total:-94.473
Area:367.832
Solvation:-103.669
Coulombic:17.8675
Bond Count [?]
All:11
Single:9
Double:2
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:-3.78
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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