CS-0766940
1-Chloro-6-(Trifluoromethoxy)isoquinoline
Manufacturer: ChemScene
CAS Number: 630423-44-8
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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
C₁₀H₅ClF₃NO
Molecular Weight
247.60
Synonyms
None
SMILES
FC(F)(F)OC1=CC=C2C(Cl)=NC=CC2=C1
Tpsa
22.12
Logp
3.7868
H Acceptors
2
H Donors
0
Rotatable Bonds
1
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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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₅ClF₃NO
Molecular Weight: 247.60
Synonyms: None
SMILES: FC(F)(F)OC1=CC=C2C(Cl)=NC=CC2=C1
Tpsa: 22.12
Logp: 3.7868
H Acceptors: 2
H Donors: 0
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:
C₁₀H₅ClF₃NO
Molecular Weight:
247.60
Synonyms:
None
SMILES:
FC(F)(F)OC1=CC=C2C(Cl)=NC=CC2=C1
Tpsa:
22.12
Logp:
3.7868
H Acceptors:
2
H Donors:
0
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: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: None
SMILES: NC(C#N)C1=CC2=C(OCO2)C=C1
Tpsa: 68.27
Logp: 0.93868
H Acceptors: 4
H Donors: 1
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:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
None
SMILES:
NC(C#N)C1=CC2=C(OCO2)C=C1
Tpsa:
68.27
Logp:
0.93868
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁BrO₃
Molecular Weight: 247.09
Synonyms: None
SMILES: Br.COC(=O)C(O)C1=CC=CC=C1
Tpsa: 46.53
Logp: 1.4709
H Acceptors: 3
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:
C₉H₁₁BrO₃
Molecular Weight:
247.09
Synonyms:
None
SMILES:
Br.COC(=O)C(O)C1=CC=CC=C1
Tpsa:
46.53
Logp:
1.4709
H Acceptors:
3
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: C₁₈H₁₇NO
Molecular Weight: 263.33
Synonyms: None
SMILES: [H][C@]12CN(CC3=CC=CC=C3)C[C@@]1([H])C1=CC=CC=C1C2=O
Tpsa: 20.31
Logp: 3.0985
H Acceptors: 2
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:
C₁₈H₁₇NO
Molecular Weight:
263.33
Synonyms:
None
SMILES:
[H][C@]12CN(CC3=CC=CC=C3)C[C@@]1([H])C1=CC=CC=C1C2=O
Tpsa:
20.31
Logp:
3.0985
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2