Chemical ID: 6665686

COc1ccccc1NC(=O)OCCCl
Chemical ID:
6665686
Name [?]:
2-chloroethyl (2-methoxyphenyl)aminoformate
SMILES [?]:
COc1ccccc1NC(=O)OCCCl
InChi [?]:
InChI=1/C10H12ClNO3/c1-14-9-5-3-2-4-8(9)12-10(13)15-7-6-11/h2-5H,6-7H2,1H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,4,14,13,8,3,10,15,9,11,2,12/rA:15nCOCCCCCCNCOOCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12ClNO3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.27905
Area:413.092
Solvation:-3.04825
Coulombic:-41.565
Bond Count [?]
All:15
Single:11
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:229.66
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.13
LogP (Chemaxon):2.45

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