CS-0874892
1-(2-Chloro-6-fluorobenzyl)-1,3,5,7-tetraazaadamantan-1-ium chloride
Manufacturer: ChemScene
CAS Number: 848611-91-6
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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
C₁₃H₁₇Cl₂FN₄
Molecular Weight
319.21
Synonyms
None
SMILES
C1N2CN3CN1C[N+](C2)(C3)CC4=C(C=CC=C4Cl)F.[Cl-]
Tpsa
9.72
Logp
-1.5083
H Acceptors
3
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 848611-91-6 | 1-(2-chloro-6-fluorobenzyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.1~3,7~]decane chloride | A2B Chem | -- |
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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: C₁₃H₁₇Cl₂FN₄
Molecular Weight: 319.21
Synonyms: None
SMILES: C1N2CN3CN1C[N+](C2)(C3)CC4=C(C=CC=C4Cl)F.[Cl-]
Tpsa: 9.72
Logp: -1.5083
H Acceptors: 3
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:
C₁₃H₁₇Cl₂FN₄
Molecular Weight:
319.21
Synonyms:
None
SMILES:
C1N2CN3CN1C[N+](C2)(C3)CC4=C(C=CC=C4Cl)F.[Cl-]
Tpsa:
9.72
Logp:
-1.5083
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD07776872
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂N₂O
Molecular Weight: 176.22
Synonyms: None
SMILES: C1CNC(=NC1)C2=CC(=CC=C2)O
Tpsa: 44.62
Logp: 1.1321
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD07776872
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂N₂O
Molecular Weight:
176.22
Synonyms:
None
SMILES:
C1CNC(=NC1)C2=CC(=CC=C2)O
Tpsa:
44.62
Logp:
1.1321
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇BrClNO₄S
Molecular Weight: 328.57
Synonyms: None
SMILES: CS(=O)(=O)C1=CC(=C(C(=C1)Cl)CBr)[N+](=O)[O-]
Tpsa: 77.28
Logp: 2.5466
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇BrClNO₄S
Molecular Weight:
328.57
Synonyms:
None
SMILES:
CS(=O)(=O)C1=CC(=C(C(=C1)Cl)CBr)[N+](=O)[O-]
Tpsa:
77.28
Logp:
2.5466
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂FNO₄S
Molecular Weight: 285.29
Synonyms: None
SMILES: CCOC(=O)C1=CC2=CC(=CC(=C2N1)F)S(=O)(=O)C
Tpsa: 76.23
Logp: 1.8872
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂FNO₄S
Molecular Weight:
285.29
Synonyms:
None
SMILES:
CCOC(=O)C1=CC2=CC(=CC(=C2N1)F)S(=O)(=O)C
Tpsa:
76.23
Logp:
1.8872
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3