Chemical ID: 4962814

CC(C)C(C)(C(=O)O)N
Chemical ID:
4962814
Name [?]:
2-amino-2,3-dimethyl-butanoic acid
SMILES [?]:
CC(C)C(C)(C(=O)O)N
InChi [?]:
InChI=1/C6H13NO2/c1-4(2)6(3,7)5(8)9/h4H,7H2,1-3H3,(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,3,5,2,6,4,9,7,8/E:(1,2)(8,9)/rA:9cCCCCCCOON/rB:s1;s2;s2;s4;s4;d6;s6;s4;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H13NO2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:1
ZAP Information [?]
Total:5.38034
Area:281.489
Solvation:-1.65687
Coulombic:-39.9904
Bond Count [?]
All:8
Single:7
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:131.173
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:-2.06
LogP (Chemaxon):-1.76

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue