Chemical ID: 6047240

CN(CCC(=O)OC)N=O
Chemical ID:
6047240
Name [?]:
methyl 3-(methyl-nitroso-amino)propanoate
SMILES [?]:
CN(CCC(=O)OC)N=O
InChi [?]:
InChI=1/C5H10N2O3/c1-7(6-9)4-3-5(8)10-2/h3-4H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,4,3,5,9,2,6,10,7/rA:10nCNCCCOOCNO/rB:s1;s2;s3;s4;d5;s5;s7;s2;d9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H10N2O3
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.76918
Area:320.732
Solvation:-2.24913
Coulombic:-21.029
Bond Count [?]
All:9
Single:7
Double:2
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:146.145
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:-0.41
LogP (Chemaxon):-0.24

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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