Chemical ID: 4728475

CCOC(=O)Cc1cccc(c1)OC
Chemical ID:
4728475
Name [?]:
ethyl 2-(3-methoxyphenyl)acetate
SMILES [?]:
CCOC(=O)Cc1cccc(c1)OC
InChi [?]:
InChI=1/C11H14O3/c1-3-14-11(12)8-9-5-4-6-10(7-9)13-2/h4-7H,3,8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,2,9,8,10,12,6,7,11,4,5,13,3/rA:14nCCOCOCCCCCCCOC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s9;d10;d7s11;s11;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14O3
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.2979
Area:383.868
Solvation:-3.2988
Coulombic:-25.7705
Bond Count [?]
All:14
Single:10
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:194.227
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.11
LogP (Chemaxon):1.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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