CS-1053281
3-Isopropyl-4-(trifluoromethyl)isothiazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 3033393-73-3
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₈H₈F₃NO₂S
Molecular Weight
239.21
Synonyms
None
SMILES
O=C(C1=C(C(F)(F)F)C(C(C)C)=NS1)O
Tpsa
50.19
Logp
2.9835
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈F₃NO₂S
Molecular Weight: 239.21
Synonyms: None
SMILES: O=C(C1=C(C(F)(F)F)C(C(C)C)=NS1)O
Tpsa: 50.19
Logp: 2.9835
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈F₃NO₂S
Molecular Weight:
239.21
Synonyms:
None
SMILES:
O=C(C1=C(C(F)(F)F)C(C(C)C)=NS1)O
Tpsa:
50.19
Logp:
2.9835
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂N₂O₂S
Molecular Weight: 200.26
Synonyms: None
SMILES: O=C(C1=C(N)C(C(C)C)=NS1)OC
Tpsa: 65.21
Logp: 1.6353
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂N₂O₂S
Molecular Weight:
200.26
Synonyms:
None
SMILES:
O=C(C1=C(N)C(C(C)C)=NS1)OC
Tpsa:
65.21
Logp:
1.6353
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀INO₂S
Molecular Weight: 311.14
Synonyms: None
SMILES: O=C(C1=C(I)C(C(C)C)=NS1)OC
Tpsa: 39.19
Logp: 2.6577
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀INO₂S
Molecular Weight:
311.14
Synonyms:
None
SMILES:
O=C(C1=C(I)C(C(C)C)=NS1)OC
Tpsa:
39.19
Logp:
2.6577
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈N₂O
Molecular Weight: 148.16
Synonyms: None
SMILES: N#CCC(C=C1)=CN(C)C1=O
Tpsa: 45.79
Logp: 0.45138
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈N₂O
Molecular Weight:
148.16
Synonyms:
None
SMILES:
N#CCC(C=C1)=CN(C)C1=O
Tpsa:
45.79
Logp:
0.45138
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1