Chemical ID: 6660685

CCOC(=O)c1ccc(c(c1)OC)O
Chemical ID:
6660685
Name [?]:
ethyl 4-hydroxy-3-methoxy-benzoate
SMILES [?]:
CCOC(=O)c1ccc(c(c1)OC)O
InChi [?]:
InChI=1/C10H12O4/c1-3-14-10(12)7-4-5-8(11)9(6-7)13-2/h4-6,11H,3H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,2,7,8,11,6,9,10,4,14,5,12,3/rA:14nCCOCOCCCCCCOCO/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;d6s10;s10;s12;s9;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12O4
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.63293
Area:376.279
Solvation:-3.77404
Coulombic:-42.9105
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:196.2
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.89
LogP (Chemaxon):1.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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