Chemical ID: 4727563

c1ccc2c(c1)nc(s2)O
Chemical ID:
4727563
Name [?]:
benzothiazol-2-ol
SMILES [?]:
c1ccc2c(c1)nc(s2)O
InChi [?]:
InChI=1/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,8,7,10,9/rA:10nCCCCCCNCSO/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H5NOS
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.79853
Area:292.371
Solvation:-1.51075
Coulombic:-24.3286
Bond Count [?]
All:11
Single:7
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:151.187
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.53
LogP (Chemaxon):2.8

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Experimental Annotations

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Descriptor Annotations

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