CS-0457556
Ethyl 5-(3-(trifluoromethyl)phenyl)isoxazole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 871676-36-7
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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
C₁₃H₁₀F₃NO₃
Molecular Weight
285.22
Synonyms
Ethyl 5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxylate
SMILES
O=C(C1=NOC(C2=CC=CC(C(F)(F)F)=C2)=C1)OCC
Tpsa
52.33
Logp
3.5371
H Acceptors
4
H Donors
0
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 871676-36-7 | 5-(3-(Trifluoromethyl)phenyl)-isoxazole-3-carboxylic acid ethyl ester, 97% | 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: C₁₃H₁₀F₃NO₃
Molecular Weight: 285.22
Synonyms: Ethyl 5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxylate
SMILES: O=C(C1=NOC(C2=CC=CC(C(F)(F)F)=C2)=C1)OCC
Tpsa: 52.33
Logp: 3.5371
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₀F₃NO₃
Molecular Weight:
285.22
Synonyms:
Ethyl 5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxylate
SMILES:
O=C(C1=NOC(C2=CC=CC(C(F)(F)F)=C2)=C1)OCC
Tpsa:
52.33
Logp:
3.5371
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁N₃
Molecular Weight: 149.19
Synonyms: 4-Amino-2-(cyclobutyl)pyrimidine
SMILES: NC1=NC(C2CCC2)=NC=C1
Tpsa: 51.8
Logp: 1.3263
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₁N₃
Molecular Weight:
149.19
Synonyms:
4-Amino-2-(cyclobutyl)pyrimidine
SMILES:
NC1=NC(C2CCC2)=NC=C1
Tpsa:
51.8
Logp:
1.3263
H Acceptors:
3
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: C₁₆H₁₀N₂O₄
Molecular Weight: 294.26
Synonyms: None
SMILES: O=C(C1=CC(C2=CC=CC=C2)=NC3=CC=C([N+]([O-])=O)C=C13)O
Tpsa: 93.33
Logp: 3.5082
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₀N₂O₄
Molecular Weight:
294.26
Synonyms:
None
SMILES:
O=C(C1=CC(C2=CC=CC=C2)=NC3=CC=C([N+]([O-])=O)C=C13)O
Tpsa:
93.33
Logp:
3.5082
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₁NO₁₀
Molecular Weight: 435.38
Synonyms: None
SMILES: OC1[C@H](N2C(C3=CC=CC=C3C2=O)=O)[C@H]([C@@H]([C@@H](COC(C)=O)O1)OC(C)=O)OC(C)=O
Tpsa: 145.74
Logp: -0.2051
H Acceptors: 10
H Donors: 1
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:
C₂₀H₂₁NO₁₀
Molecular Weight:
435.38
Synonyms:
None
SMILES:
OC1[C@H](N2C(C3=CC=CC=C3C2=O)=O)[C@H]([C@@H]([C@@H](COC(C)=O)O1)OC(C)=O)OC(C)=O
Tpsa:
145.74
Logp:
-0.2051
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
5