Chemical ID: 4909084

CCCCNC(=O)OCC(C)(CCC)COC(=O)N
Chemical ID:
4909084
Name [?]:
[2-(carbamoyloxymethyl)-2-methyl-pentyl] butylaminoformate
SMILES [?]:
CCCCNC(=O)OCC(C)(CCC)COC(=O)N
InChi [?]:
InChI=1/C13H26N2O4/c1-4-6-8-15-12(17)19-10-13(3,7-5-2)9-18-11(14)16/h4-10H2,1-3H3,(H2,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,14,11,2,13,3,12,4,15,9,17,6,10,19,5,18,7,16,8/rA:19cCCCCNCOOCCCCCCCOCON/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s10;s12;s13;s10;s15;s16;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H26N2O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:10.7453
Area:526.731
Solvation:-2.423
Coulombic:-72.378
Bond Count [?]
All:18
Single:16
Double:2
Rotors:12
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:274.357
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:2.57
LogP (Chemaxon):2.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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