CS-0877343
Methyl 5-(2-(trifluoromethyl)phenyl)isoxazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 668970-86-3
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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
C₁₂H₈F₃NO₃
Molecular Weight
271.19
Synonyms
None
SMILES
COC(=O)C1=NOC(=C1)C2=CC=CC=C2C(F)(F)F
Tpsa
52.33
Logp
3.147
H Acceptors
4
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 668970-86-3 | 3-Isoxazolecarboxylic acid, 5-[2-(trifluoromethyl)phenyl]-, methyl ester | A2B Chem | -- |
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: C₁₂H₈F₃NO₃
Molecular Weight: 271.19
Synonyms: None
SMILES: COC(=O)C1=NOC(=C1)C2=CC=CC=C2C(F)(F)F
Tpsa: 52.33
Logp: 3.147
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:
C₁₂H₈F₃NO₃
Molecular Weight:
271.19
Synonyms:
None
SMILES:
COC(=O)C1=NOC(=C1)C2=CC=CC=C2C(F)(F)F
Tpsa:
52.33
Logp:
3.147
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁BrClN₃
Molecular Weight: 276.56
Synonyms: None
SMILES: CC(C)C1=NN=C2N1C=C(C=C2)Br.Cl
Tpsa: 30.19
Logp: 3.037
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁BrClN₃
Molecular Weight:
276.56
Synonyms:
None
SMILES:
CC(C)C1=NN=C2N1C=C(C=C2)Br.Cl
Tpsa:
30.19
Logp:
3.037
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: C₈H₁₈ClN₃
Molecular Weight: 191.70
Synonyms: None
SMILES: CCNC1=NCCC[N+]1(C)C.[Cl-]
Tpsa: 24.39
Logp: -2.564
H Acceptors: 2
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:
C₈H₁₈ClN₃
Molecular Weight:
191.70
Synonyms:
None
SMILES:
CCNC1=NCCC[N+]1(C)C.[Cl-]
Tpsa:
24.39
Logp:
-2.564
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₀FNO₄
Molecular Weight: 275.23
Synonyms: None
SMILES: COC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2F)[N+](=O)[O-]
Tpsa: 69.44
Logp: 2.9735
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₀FNO₄
Molecular Weight:
275.23
Synonyms:
None
SMILES:
COC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2F)[N+](=O)[O-]
Tpsa:
69.44
Logp:
2.9735
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4