CS-1068680
Methyl 4-cyano-3-(trifluoromethyl)isothiazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 269401-34-5
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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
C₇H₃F₃N₂O₂S
Molecular Weight
236.17
Synonyms
None
SMILES
N#CC1=C(SN=C1C(F)(F)F)C(=O)OC
Tpsa
62.98
Logp
1.82018
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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: C₇H₃F₃N₂O₂S
Molecular Weight: 236.17
Synonyms: None
SMILES: N#CC1=C(SN=C1C(F)(F)F)C(=O)OC
Tpsa: 62.98
Logp: 1.82018
H Acceptors: 5
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:
C₇H₃F₃N₂O₂S
Molecular Weight:
236.17
Synonyms:
None
SMILES:
N#CC1=C(SN=C1C(F)(F)F)C(=O)OC
Tpsa:
62.98
Logp:
1.82018
H Acceptors:
5
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: C₆HF₃N₂O₂S
Molecular Weight: 222.14
Synonyms: None
SMILES: N#CC1=C(SN=C1C(F)(F)F)C(=O)O
Tpsa: 73.98
Logp: 1.73178
H Acceptors: 4
H Donors: 1
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:
C₆HF₃N₂O₂S
Molecular Weight:
222.14
Synonyms:
None
SMILES:
N#CC1=C(SN=C1C(F)(F)F)C(=O)O
Tpsa:
73.98
Logp:
1.73178
H Acceptors:
4
H Donors:
1
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: C₇H₆N₂O₂S
Molecular Weight: 182.20
Synonyms: None
SMILES: N#CC1=C(SN=C1C)C(=O)OC
Tpsa: 62.98
Logp: 1.1098
H Acceptors: 5
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:
C₇H₆N₂O₂S
Molecular Weight:
182.20
Synonyms:
None
SMILES:
N#CC1=C(SN=C1C)C(=O)OC
Tpsa:
62.98
Logp:
1.1098
H Acceptors:
5
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: C₁₂H₁₈O₄
Molecular Weight: 226.27
Synonyms: None
SMILES: O=C(OC)C1C=C(CCCC)C1C(=O)OC
Tpsa: 52.6
Logp: 1.695
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₈O₄
Molecular Weight:
226.27
Synonyms:
None
SMILES:
O=C(OC)C1C=C(CCCC)C1C(=O)OC
Tpsa:
52.6
Logp:
1.695
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5