Chemical ID: 7121952

CCOc1ccc(cc1OC)C(=O)[O-]
Chemical ID:
7121952
Name [?]:
4-ethoxy-3-methoxy-benzoate
SMILES [?]:
CCOc1ccc(cc1OC)C(=O)[O-]
InChi [?]:
InChI=1/C10H12O4/c1-3-14-8-5-4-7(10(11)12)6-9(8)13-2/h4-6H,3H2,1-2H3,(H,11,12)/p-1
InChi Info:
AuxInfo=1/1/N:1,11,2,6,5,8,7,4,9,12,13,14,10,3/E:(11,12)/rA:14nCCOCCCCCCOCCOO-/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s7;d12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11O4-
All Atoms:25
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:-34.1652
Area:369.513
Solvation:-43.403
Coulombic:-17.345
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:195.192
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.14
LogP (Chemaxon):1.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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