CS-0915103
Celecoxib Trifluro Impurity Sitagliptin Impurity 26
Manufacturer: ChemScene
CAS Number: 910303-54-7
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₁H₉F₃O₂
Molecular Weight
230.18
Synonyms
None
SMILES
C(=C\C(C(F)(F)F)=O)(\O)/C1=CC=C(C)C=C1
Tpsa
37.3
Logp
3.02532
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉F₃O₂
Molecular Weight: 230.18
Synonyms: None
SMILES: C(=C\C(C(F)(F)F)=O)(\O)/C1=CC=C(C)C=C1
Tpsa: 37.3
Logp: 3.02532
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉F₃O₂
Molecular Weight:
230.18
Synonyms:
None
SMILES:
C(=C\C(C(F)(F)F)=O)(\O)/C1=CC=C(C)C=C1
Tpsa:
37.3
Logp:
3.02532
H Acceptors:
2
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: C₂₇H₂₆N₂O₇
Molecular Weight: 490.50
Synonyms: None
SMILES: C(OC/C=C\C1=CC=CC=C1)(=O)C=2C(=C(C(OCCOC)=O)C(C)=NC2C)C3=CC(N(=O)=O)=CC=C3
Tpsa: 117.86
Logp: 4.94704
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₂₆N₂O₇
Molecular Weight:
490.50
Synonyms:
None
SMILES:
C(OC/C=C\C1=CC=CC=C1)(=O)C=2C(=C(C(OCCOC)=O)C(C)=NC2C)C3=CC(N(=O)=O)=CC=C3
Tpsa:
117.86
Logp:
4.94704
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₅₄N₂O₁₀
Molecular Weight: 590.75
Synonyms: None
SMILES: O([C@H]1[C@H](O)[C@@H](N(C)C)C[C@@H](C)O1)[C@H]2[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@H](C)[C@@H](O)[C@@H]2C
Tpsa: 181.74
Logp: 1.1215
H Acceptors: 12
H Donors: 6
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:
C₂₉H₅₄N₂O₁₀
Molecular Weight:
590.75
Synonyms:
None
SMILES:
O([C@H]1[C@H](O)[C@@H](N(C)C)C[C@@H](C)O1)[C@H]2[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@H](C)[C@@H](O)[C@@H]2C
Tpsa:
181.74
Logp:
1.1215
H Acceptors:
12
H Donors:
6
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: C₁₃H₁₆N₄O
Molecular Weight: 244.29
Synonyms: None
SMILES: N#CC=1C=C(C=C(C#N)C1N)C(O)NC(C)(C)C
Tpsa: 105.86
Logp: 1.39116
H Acceptors: 5
H Donors: 3
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:
C₁₃H₁₆N₄O
Molecular Weight:
244.29
Synonyms:
None
SMILES:
N#CC=1C=C(C=C(C#N)C1N)C(O)NC(C)(C)C
Tpsa:
105.86
Logp:
1.39116
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
2