Chemical ID: 6667223

Cc1cccc(c1NC(=O)OCC=C)C
Chemical ID:
6667223
Name [?]:
allyl (2,6-dimethylphenyl)aminoformate
SMILES [?]:
Cc1cccc(c1NC(=O)OCC=C)C
InChi [?]:
InChI=1/C12H15NO2/c1-4-8-15-12(14)13-11-9(2)6-5-7-10(11)3/h4-7H,1,8H2,2-3H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:14,1,15,13,4,3,5,12,2,6,7,9,8,10,11/E:(2,3)(6,7)(9,10)/rA:15nCCCCCCCNCOOCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;d13;s6;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H15NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.35241
Area:399.261
Solvation:-1.62912
Coulombic:-35.6954
Bond Count [?]
All:15
Single:10
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:205.253
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.51
LogP (Chemaxon):3.67

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Descriptor Annotations

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