Chemical ID: 4408859

CC(C)CN(CCC(=O)O)CC(C)C
Chemical ID:
4408859
Name [?]:
3-diisobutylaminopropanoic acid
SMILES [?]:
CC(C)CN(CCC(=O)O)CC(C)C
InChi [?]:
InChI=1/C11H23NO2/c1-9(2)7-12(8-10(3)4)6-5-11(13)14/h9-10H,5-8H2,1-4H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,13,14,7,6,4,11,2,12,8,5,9,10/E:(1,2,3,4)(7,8)(9,10)(13,14)/rA:14nCCCCNCCCOOCCCC/rB:s1;s2;s2;s4;s5;s6;s7;d8;s8;s5;s11;s12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H23NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.58874
Area:407.854
Solvation:-1.6076
Coulombic:-32.0624
Bond Count [?]
All:13
Single:12
Double:1
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:201.306
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.76
LogP (Chemaxon):-0.36

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