CS-0604232
3-Cyano-5-methyl-N-(4-(trifluoromethyl)phenyl)isoxazole-4-carboxamide
Manufacturer: ChemScene
CAS Number: 400074-24-0
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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
C₁₃H₈F₃N₃O₂
Molecular Weight
295.22
Synonyms
None
SMILES
CC1=C(C(=NO1)C#N)C(=O)NC2=CC=C(C=C2)C(F)(F)F
Tpsa
78.92
Logp
3.1258
H Acceptors
4
H Donors
1
Rotatable Bonds
2
Related Products
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: C₁₃H₈F₃N₃O₂
Molecular Weight: 295.22
Synonyms: None
SMILES: CC1=C(C(=NO1)C#N)C(=O)NC2=CC=C(C=C2)C(F)(F)F
Tpsa: 78.92
Logp: 3.1258
H Acceptors: 4
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:
C₁₃H₈F₃N₃O₂
Molecular Weight:
295.22
Synonyms:
None
SMILES:
CC1=C(C(=NO1)C#N)C(=O)NC2=CC=C(C=C2)C(F)(F)F
Tpsa:
78.92
Logp:
3.1258
H Acceptors:
4
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: C₃₁H₃₆BrN₂O₃P
Molecular Weight: 595.51
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CC[C@@H](C1)N2CCC(C2=O)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]
Tpsa: 49.85
Logp: 1.5948
H Acceptors: 3
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:
C₃₁H₃₆BrN₂O₃P
Molecular Weight:
595.51
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CC[C@@H](C1)N2CCC(C2=O)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]
Tpsa:
49.85
Logp:
1.5948
H Acceptors:
3
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: C₆H₁₀F₃NO
Molecular Weight: 169.14
Synonyms: None
SMILES: CCCCNC(=O)C(F)(F)F
Tpsa: 29.1
Logp: 1.465
H Acceptors: 1
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:
C₆H₁₀F₃NO
Molecular Weight:
169.14
Synonyms:
None
SMILES:
CCCCNC(=O)C(F)(F)F
Tpsa:
29.1
Logp:
1.465
H Acceptors:
1
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: C₄H₄N₄O₃
Molecular Weight: 156.10
Synonyms: None
SMILES: C1=NNC(=N1)NC(=O)C(=O)O
Tpsa: 107.97
Logp: -1.1722
H Acceptors: 4
H Donors: 3
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:
C₄H₄N₄O₃
Molecular Weight:
156.10
Synonyms:
None
SMILES:
C1=NNC(=N1)NC(=O)C(=O)O
Tpsa:
107.97
Logp:
-1.1722
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
1