Chemical ID: 4956607

CCC(CC)(COC(=O)N)COC(=O)N
Chemical ID:
4956607
Name [?]:
[2-(carbamoyloxymethyl)-2-ethyl-butyl] aminoformate
SMILES [?]:
CCC(CC)(COC(=O)N)COC(=O)N
InChi [?]:
InChI=1/C9H18N2O4/c1-3-9(4-2,5-14-7(10)12)6-15-8(11)13/h3-6H2,1-2H3,(H2,10,12)(H2,11,13)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,6,11,8,13,3,10,15,9,14,7,12/E:(1,2)(3,4)(5,6)(7,8)(10,11)(12,13)(14,15)/gE:(1,2)/rA:15nCCCCCCOCONCOCON/rB:s1;s2;s3;s4;s3;s6;s7;d8;s8;s3;s11;s12;d13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H18N2O4
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.84654
Area:411.985
Solvation:-2.45308
Coulombic:-75.3094
Bond Count [?]
All:14
Single:12
Double:2
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:218.25
H-Bond Donors:4
H-Bond Acceptors:6
XLogP:0.7
LogP (Chemaxon):0.96

Name Annotations

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Descriptor Annotations

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