Chemical ID: 5023719

CC1CN1CCC(=O)OC
Chemical ID:
5023719
Name [?]:
methyl 3-(2-methylaziridin-1-yl)propanoate
SMILES [?]:
CC1CN1CCC(=O)OC
InChi [?]:
InChI=1/C7H13NO2/c1-6-5-8(6)4-3-7(9)10-2/h6H,3-5H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,10,6,5,3,2,7,4,8,9/rA:10cCCCNCCCOOC/rB:s1;s2;s2s3;s4;s5;s6;d7;s7;s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H13NO2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:2
ZAP Information [?]
Total:6.05544
Area:321.301
Solvation:-1.97708
Coulombic:-22.4792
Bond Count [?]
All:10
Single:9
Double:1
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:143.184
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.17
LogP (Chemaxon):0.15

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