CS-1094332
5-Methyl-3-((3-oxo-3-phenylprop-1-en-1-yl)thio)isothiazole-4-carbonitrile
Manufacturer: ChemScene
CAS Number: 338953-37-0
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₄H₁₀N₂OS₂
Molecular Weight
286.37
Synonyms
None
SMILES
N#CC=1C(=NSC1C)SC=CC(=O)C=2C=CC=CC2
Tpsa
53.75
Logp
3.8119
H Acceptors
5
H Donors
0
Rotatable Bonds
4
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₀N₂OS₂
Molecular Weight: 286.37
Synonyms: None
SMILES: N#CC=1C(=NSC1C)SC=CC(=O)C=2C=CC=CC2
Tpsa: 53.75
Logp: 3.8119
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₀N₂OS₂
Molecular Weight:
286.37
Synonyms:
None
SMILES:
N#CC=1C(=NSC1C)SC=CC(=O)C=2C=CC=CC2
Tpsa:
53.75
Logp:
3.8119
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈ClF₃N₄
Molecular Weight: 300.67
Synonyms: None
SMILES: FC(F)(F)C1=CN=C(NN=CC=2C=CN=CC2)C(Cl)=C1
Tpsa: 50.17
Logp: 3.5948
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈ClF₃N₄
Molecular Weight:
300.67
Synonyms:
None
SMILES:
FC(F)(F)C1=CN=C(NN=CC=2C=CN=CC2)C(Cl)=C1
Tpsa:
50.17
Logp:
3.5948
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₉NOS₂
Molecular Weight: 259.35
Synonyms: None
SMILES: N#CC(=CC=1SC=CC1)C=2SC(=CC2)C(=O)C
Tpsa: 40.86
Logp: 4.07638
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₉NOS₂
Molecular Weight:
259.35
Synonyms:
None
SMILES:
N#CC(=CC=1SC=CC1)C=2SC(=CC2)C(=O)C
Tpsa:
40.86
Logp:
4.07638
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₉Cl₂NOS
Molecular Weight: 322.21
Synonyms: None
SMILES: N#CC(=CC1=CC=C(Cl)C=C1Cl)C=2SC(=CC2)C(=O)C
Tpsa: 40.86
Logp: 5.32168
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₉Cl₂NOS
Molecular Weight:
322.21
Synonyms:
None
SMILES:
N#CC(=CC1=CC=C(Cl)C=C1Cl)C=2SC(=CC2)C(=O)C
Tpsa:
40.86
Logp:
5.32168
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3