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Structure

(2S,4S)-(-)-4-Isopropyl-2-p-toluene-4,5-dihydro-(1,2lambda6,3)-oxathiazole 2-oxide

CAS
145679-46-5
Catalog Number
ACM145679465
Category
Other Products
Molecular Weight
239.33
Molecular Formula
C12H17NO2S

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Specification

Synonyms
CTK8E6997, (2S,4S)-4,5-Dihydro-4-isopropyl-2-(p-tolyl)-1,2 4,3-oxathiazole 2-oxide, 145679-46-5
IUPAC Name
(2S,4S)-2-(4-methylphenyl)-4-propan-2-yl-1-oxa-2$l^{6}-thia-3-azacyclopent-2-ene 2-oxide
Canonical SMILES
CC1=CC=C(C=C1)S2(=NC(CO2)C(C)C)=O
InChI Key
QCNBRUOJSNBOIE-WBMJQRKESA-N
Boiling Point
336.8ºC at 760mmHg
Melting Point
82-84ºC(lit.)
Flash Point
157.5ºC
Density
1.19g/cm³
Exact Mass
239.09800
H-Bond Acceptor
3
H-Bond Donor
0
WGK Germany
3
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