ChemicalBook--->CAS DataBase List--->4299-07-4

4299-07-4

4299-07-4 Structure

4299-07-4 Structure
IdentificationMore
[Name]

2-Butyl-1,2-benzisothiazolin-3-one
[CAS]

4299-07-4
[Synonyms]

2-butyl-1,2-benzisothiazolin-3-one
2-Butyl-1,2-Benziso-Thiazol-3(2h)-One
2-n-Butyl-1,2-benzisothiazolin-3-on
N-BUTYL-1,2-BENZISOTHIAZOLIN-3-ONE
2-BUTYL-BENZO(D)ISOTHIAZOLIN-3-ONE
2-n-Butyl-benzo[d]isothiazol-3-one
2-BENZISOTHIAZOL-3(2H)-ONE, 2-BUTYL-1
[EINECS(EC#)]

1312995-182-4
[Molecular Formula]

C11H13NOS
[MDL Number]

MFCD09751282
[Molecular Weight]

207.292
[MOL File]

4299-07-4.mol
Chemical PropertiesBack Directory
[Melting point ]

137-138°
[Boiling point ]

332.9±25.0 °C(Predicted)
[density ]

1.176±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Methanol (Slightly)
[form ]

clear liquid
[pka]

-2.10±0.20(Predicted)
[color ]

Light yellow to Yellow to Orange
[InChI]

InChI=1S/C11H13NOS/c1-2-3-8-12-11(13)9-6-4-5-7-10(9)14-12/h4-7H,2-3,8H2,1H3
[InChIKey]

LUYIHWDYPAZCNN-UHFFFAOYSA-N
[SMILES]

S1C2=C(C=CC=C2)C(=O)N1CCCC
[CAS DataBase Reference]

4299-07-4(CAS DataBase Reference)
[EPA Substance Registry System]

4299-07-4(EPA Substance)
Safety DataBack Directory
[RIDADR ]

UN1760
[HS Code ]

2934.20.8000
[HazardClass ]

8
Hazard InformationBack Directory
[Uses]

2-Butyl-1,2-benzisothiazolin-3-one is a heterocyclic organic compound and can be used as a pharmaceutical intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Butyl-1,2-benzisothiazolin-3-one(4299-07-4)1HNMR
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