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Tebipenem Pivoxil Impurity 7

CAT: 1596-AR-T01266-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-T01266-01Size:10 Units
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CAS Number
19975-56-5
Synonyms
2- (methylthio) -4,5-dihydrothiazole; 2- (Methylsulfanyl) -4,5-dihydrothiazole; 2- (Methylthio) -4,5-dihydro-1,3-thiazole; 2- (Methylthio) -4,5-dihydrothiazole; 2- (Methylthio) thiazoline; 4,5-Dihydro-2-methylthiothiazole; NSC 196203
Molecular Formula
C4H7NS2
Molecular Weight
133.23
API Name
Tebipenem Pivoxil

Chemical Information

4,5-Dihydro-2-(methylthio)thiazole
CAS Number19975-56-5
PubChem CID88324
IUPAC Name2-methylsulfanyl-4,5-dihydro-1,3-thiazole
Molecular FormulaC4H7NS2
Molecular Weight133.2
XLogP1.3
Topological Polar Surface Area63
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count7
Formal Charge0
Complexity89
SMILES
CSC1=NCCS1
InChI
InChI=1S/C4H7NS2/c1-6-4-5-2-3-7-4/h2-3H2,1H3
InChIKey
QFGRBBWYHIYNIB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,5-Dihydro-2-(methylthio)thiazole
CAS: 19975-56-5
CID: 88324
Formula: C4H7NS2
MW: 133.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight133.2
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass133.00199157
Monoisotopic Mass133.00199157
Topological Polar Surface Area63 Ų
Heavy Atom Count7
Formal Charge0
Complexity89.7
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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