CS-0594911
2,2,2-Trifluoroethyl 6-(3-methyl-1H-1,2,4-triazol-1-yl)nicotinate
Manufacturer: ChemScene
CAS Number: 400081-97-2
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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
C₁₁H₉F₃N₄O₂
Molecular Weight
286.21
Synonyms
None
SMILES
CC1=NN(C=N1)C2=NC=C(C=C2)C(=O)OCC(F)(F)F
Tpsa
69.9
Logp
1.68982
H Acceptors
6
H Donors
0
Rotatable Bonds
3
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: C₁₁H₉F₃N₄O₂
Molecular Weight: 286.21
Synonyms: None
SMILES: CC1=NN(C=N1)C2=NC=C(C=C2)C(=O)OCC(F)(F)F
Tpsa: 69.9
Logp: 1.68982
H Acceptors: 6
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:
C₁₁H₉F₃N₄O₂
Molecular Weight:
286.21
Synonyms:
None
SMILES:
CC1=NN(C=N1)C2=NC=C(C=C2)C(=O)OCC(F)(F)F
Tpsa:
69.9
Logp:
1.68982
H Acceptors:
6
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: C₁₄H₁₁N₃O
Molecular Weight: 237.26
Synonyms: None
SMILES: C1=CN(C=C1)C2=CC=C(C=C2)OC3=NC=CC=N3
Tpsa: 39.94
Logp: 3.0596
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:
C₁₄H₁₁N₃O
Molecular Weight:
237.26
Synonyms:
None
SMILES:
C1=CN(C=C1)C2=CC=C(C=C2)OC3=NC=CC=N3
Tpsa:
39.94
Logp:
3.0596
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: C₁₃H₁₃N₃O₂
Molecular Weight: 243.26
Synonyms: None
SMILES: C1CC1C(=O)OCC2=CN(N=N2)C3=CC=CC=C3
Tpsa: 57.01
Logp: 1.7205
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃N₃O₂
Molecular Weight:
243.26
Synonyms:
None
SMILES:
C1CC1C(=O)OCC2=CN(N=N2)C3=CC=CC=C3
Tpsa:
57.01
Logp:
1.7205
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂FN₃O
Molecular Weight: 197.21
Synonyms: None
SMILES: CC(C)(N)C(NC1=NC=C(F)C=C1)=O
Tpsa: 68.01
Logp: 0.8965
H Acceptors: 3
H Donors: 2
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:
C₉H₁₂FN₃O
Molecular Weight:
197.21
Synonyms:
None
SMILES:
CC(C)(N)C(NC1=NC=C(F)C=C1)=O
Tpsa:
68.01
Logp:
0.8965
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2