Chemical ID: 3967465

COC(=O)c1ccccc1O
Chemical ID:
3967465
Name [?]:
methyl 2-hydroxybenzoate
SMILES [?]:
COC(=O)c1ccccc1O
InChi [?]:
InChI=1/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3
InChi Info:
AuxInfo=1/0/N:1,7,8,6,9,5,10,3,11,4,2/rA:11nCOCOCCCCCCO/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H8O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.12822
Area:306.484
Solvation:-2.53387
Coulombic:-36.057
Bond Count [?]
All:11
Single:7
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:152.147
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.54
LogP (Chemaxon):1.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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