CS-0877654
2-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)methyl)isoquinolin-2-ium bromide
Manufacturer: ChemScene
CAS Number: 648427-33-2
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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
C₁₆H₁₁BrClF₃N₂
Molecular Weight
403.62
Synonyms
None
SMILES
C1=CC=C2C=[N+](C=CC2=C1)CC3=C(C=C(C=N3)C(F)(F)F)Cl.[Br-]
Tpsa
16.77
Logp
1.2468
H Acceptors
1
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 648427-33-2 | 2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl}isoquinolinium bromide | 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: C₁₆H₁₁BrClF₃N₂
Molecular Weight: 403.62
Synonyms: None
SMILES: C1=CC=C2C=[N+](C=CC2=C1)CC3=C(C=C(C=N3)C(F)(F)F)Cl.[Br-]
Tpsa: 16.77
Logp: 1.2468
H Acceptors: 1
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:
C₁₆H₁₁BrClF₃N₂
Molecular Weight:
403.62
Synonyms:
None
SMILES:
C1=CC=C2C=[N+](C=CC2=C1)CC3=C(C=C(C=N3)C(F)(F)F)Cl.[Br-]
Tpsa:
16.77
Logp:
1.2468
H Acceptors:
1
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: C₁₂H₉BrClF₃N₂
Molecular Weight: 353.57
Synonyms: None
SMILES: C1=CC=[N+](C=C1)CC2=C(C=C(C=N2)C(F)(F)F)Cl.[Br-]
Tpsa: 16.77
Logp: 0.0936
H Acceptors: 1
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:
C₁₂H₉BrClF₃N₂
Molecular Weight:
353.57
Synonyms:
None
SMILES:
C1=CC=[N+](C=C1)CC2=C(C=C(C=N2)C(F)(F)F)Cl.[Br-]
Tpsa:
16.77
Logp:
0.0936
H Acceptors:
1
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: C₁₄H₁₀ClNO₄
Molecular Weight: 291.69
Synonyms: None
SMILES: COC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])Cl
Tpsa: 69.44
Logp: 3.4878
H Acceptors: 4
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:
C₁₄H₁₀ClNO₄
Molecular Weight:
291.69
Synonyms:
None
SMILES:
COC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])Cl
Tpsa:
69.44
Logp:
3.4878
H Acceptors:
4
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: C₁₀H₁₂FNO₃
Molecular Weight: 213.21
Synonyms: None
SMILES: COC1=C(C=C(C=C1)NC(=O)CF)OC
Tpsa: 47.56
Logp: 1.6118
H Acceptors: 3
H Donors: 1
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:
C₁₀H₁₂FNO₃
Molecular Weight:
213.21
Synonyms:
None
SMILES:
COC1=C(C=C(C=C1)NC(=O)CF)OC
Tpsa:
47.56
Logp:
1.6118
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4