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Home > Imidazoles > 114095-02-2
114095-02-2 | Imidazo[2,1-b]benzothiazole-2-methanol
CAS No: 114095-02-2 Catalog No: AG000AJA MDL No:MFCD00203010
Product Description
Catalog Number:
AG000AJA
Chemical Name:
Imidazo[2,1-b]benzothiazole-2-methanol
CAS Number:
114095-02-2
Molecular Formula:
C10H8N2OS
Molecular Weight:
204.2483
MDL Number:
MFCD00203010
IUPAC Name:
imidazo[2,1-b][1,3]benzothiazol-2-ylmethanol
InChI:
InChI=1S/C10H8N2OS/c13-6-7-5-12-8-3-1-2-4-9(8)14-10(12)11-7/h1-5,13H,6H2
InChI Key:
CKPKCVPIDQOXIW-UHFFFAOYSA-N
SMILES:
OCc1cn2c(n1)sc1c2cccc1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.247g/mol
Monoisotopic Mass:
204.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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