Chemical ID: 4732063

CCOC(=O)c1cccc(c1O)O
Chemical ID:
4732063
Name [?]:
ethyl 2,3-dihydroxybenzoate
SMILES [?]:
CCOC(=O)c1cccc(c1O)O
InChi [?]:
InChI=1/C9H10O4/c1-2-13-9(12)6-4-3-5-7(10)8(6)11/h3-5,10-11H,2H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,8,7,9,6,10,11,4,13,12,5,3/rA:13nCCOCOCCCCCCOO/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;d6s10;s11;s10;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H10O4
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.07418
Area:348.994
Solvation:-3.65067
Coulombic:-51.4112
Bond Count [?]
All:13
Single:9
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:182.173
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.77
LogP (Chemaxon):2.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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