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CAS Number: 170283-02-0
isothiazol-3-ylmethanol

Structure

isothiazol-3-ylmethanol
Name: isothiazol-3-ylmethanol
Synonyms:
General Information
Product Number: 170283020
CAS Registry Number: 170283-02-0
Name:
        4-​Isothiazolemethanol
        4-​Hydroxymethylisothia​zole 
 
Chemical Formula: C4H5NOS
Exact Mass: 115.01
Molecular Weight: 115.15
m/z: 115.01 (100.0%), 116.01 (5.5%), 117.00 (4.5%)
Elemental Analysis: C, 41.72; H, 4.38; N, 12.16; O, 13.89; S, 27.85
 
InChI: InChI=1S/C4H5NOS/c6-2-4-1-5-7-3-4/h1,3,6H,2H2
InChIKey: OVRPVAZRSIBVJO-UHFFFAOYSA-N
Canonical SMILES : C1=C(C=NS1)CO

Specification

98%

References

PCT Int. Appl. (1996), WO 9622978 A1 19960801.                                  

PCT Int. Appl. (1995), WO 9513262 A1 19950518.                                 

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