CS-0438873
1,1,1-Trifluoro-N-((trifluoromethyl)sulfonyl)methanesulfonamide compound with (S)-1,3,3-triphenylhexahydropyrrolo[1,2-c][1,3,2]oxazaborole 1:1
Manufacturer: ChemScene
CAS Number: 956394-04-0
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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
C₂₅H₂₃BF₆N₂O₅S₂
Molecular Weight
620.39
Synonyms
None
SMILES
FC(F)(F)S(NS(C(F)(F)F)(=O)=O)(=O)=O.[H][C@]12C(C3=CC=CC=C3)(C4=CC=CC=C4)OB(C5=CC=CC=C5)N1CCC2
Tpsa
92.78
Logp
4.0954
H Acceptors
6
H Donors
1
Rotatable Bonds
5
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: C₂₅H₂₃BF₆N₂O₅S₂
Molecular Weight: 620.39
Synonyms: None
SMILES: FC(F)(F)S(NS(C(F)(F)F)(=O)=O)(=O)=O.[H][C@]12C(C3=CC=CC=C3)(C4=CC=CC=C4)OB(C5=CC=CC=C5)N1CCC2
Tpsa: 92.78
Logp: 4.0954
H Acceptors: 6
H Donors: 1
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:
C₂₅H₂₃BF₆N₂O₅S₂
Molecular Weight:
620.39
Synonyms:
None
SMILES:
FC(F)(F)S(NS(C(F)(F)F)(=O)=O)(=O)=O.[H][C@]12C(C3=CC=CC=C3)(C4=CC=CC=C4)OB(C5=CC=CC=C5)N1CCC2
Tpsa:
92.78
Logp:
4.0954
H Acceptors:
6
H Donors:
1
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: C₁₆H₁₆N₂O
Molecular Weight: 252.31
Synonyms: None
SMILES: CCC1=CC=CC(C2=N[C@H](C3=CC=CC=C3)CO2)=N1
Tpsa: 34.48
Logp: 3.1621
H Acceptors: 3
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:
C₁₆H₁₆N₂O
Molecular Weight:
252.31
Synonyms:
None
SMILES:
CCC1=CC=CC(C2=N[C@H](C3=CC=CC=C3)CO2)=N1
Tpsa:
34.48
Logp:
3.1621
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁ClFN
Molecular Weight: 187.64
Synonyms: None
SMILES: FC1=CC=C(C=C1)[C@@H]2CCN2.Cl
Tpsa: 12.03
Logp: 2.2819
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁ClFN
Molecular Weight:
187.64
Synonyms:
None
SMILES:
FC1=CC=C(C=C1)[C@@H]2CCN2.Cl
Tpsa:
12.03
Logp:
2.2819
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉BrClNO
Molecular Weight: 250.52
Synonyms: None
SMILES: BrC1=C2C(OC[C@H]2N)=CC=C1.Cl
Tpsa: 35.25
Logp: 2.2631
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉BrClNO
Molecular Weight:
250.52
Synonyms:
None
SMILES:
BrC1=C2C(OC[C@H]2N)=CC=C1.Cl
Tpsa:
35.25
Logp:
2.2631
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0