2-(2-Hydroxyphenyl)benzothiazole

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Catalog Number
ACM3411958
Product Name
2-(2-Hydroxyphenyl)benzothiazole
Structure
Structure
CAS
3411-95-8
Category
Heterocyclic Organic Compound
Synonyms
2-(1,3-Benzothiazol-2-yl)phenol
IUPAC Name
2-(1,3-benzothiazol-2-yl)phenol
Molecular Weight
227.28
Molecular Formula
C13H9NOS
Canonical SMILES
C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)O
InChI
InChI=1S/C13H9NOS/c15-11-7-3-1-5-9(11)13-14-10-6-2-4-8-12(10)16-13/h1-8,15H
InChI Key
MVVGSPCXHRFDDR-UHFFFAOYSA-N
Boiling Point
175-193 ºC
Melting Point
128-132 ºC (lit.)
Density
1.217 g/ml
Complexity
248
Covalently-Bonded Unit Count
1
EC Number
222-299-9
Exact Mass
227.04g/mol
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
16
Monoisotopic Mass
227.04g/mol
NSC Number
58548
Rotatable Bond Count
1
Topological Polar Surface Area
61.4A^2
UNII
40UQ1I362I
MSDS
Download MSDS
COA
Download COA
Spec Sheet
Download Spec Sheet
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