Chemical ID: 4727971

COC(=O)c1c(c2ccccc2s1)O
Chemical ID:
4727971
Name [?]:
methyl 3-hydroxybenzothiophene-2-carboxylate
SMILES [?]:
COC(=O)c1c(c2ccccc2s1)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C10H8O3S
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.63708
Area:362.002
Solvation:-2.41297
Coulombic:-37.0611
Bond Count [?]
All:15
Single:10
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:208.235
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.67
LogP (Chemaxon):2.75

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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