CS-0616603
3-Acetyl-2-(trifluoromethyl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1807177-22-5
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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
C₁₀H₆F₃NO
Molecular Weight
213.16
Synonyms
None
SMILES
N#CC1=CC=CC(C(C)=O)=C1C(F)(F)F
Tpsa
40.86
Logp
2.77968
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₆F₃NO
Molecular Weight: 213.16
Synonyms: None
SMILES: N#CC1=CC=CC(C(C)=O)=C1C(F)(F)F
Tpsa: 40.86
Logp: 2.77968
H Acceptors: 2
H Donors: 0
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:
C₁₀H₆F₃NO
Molecular Weight:
213.16
Synonyms:
None
SMILES:
N#CC1=CC=CC(C(C)=O)=C1C(F)(F)F
Tpsa:
40.86
Logp:
2.77968
H Acceptors:
2
H Donors:
0
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: C₇H₆BrN₃
Molecular Weight: 212.05
Synonyms: None
SMILES: N#CC(N)C1=NC=C(Br)C=C1
Tpsa: 62.7
Logp: 1.36748
H Acceptors: 3
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:
C₇H₆BrN₃
Molecular Weight:
212.05
Synonyms:
None
SMILES:
N#CC(N)C1=NC=C(Br)C=C1
Tpsa:
62.7
Logp:
1.36748
H Acceptors:
3
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: C₈H₄ClF₃N₂
Molecular Weight: 220.58
Synonyms: None
SMILES: N#CC1=CC(N)=C(Cl)C=C1C(F)(F)F
Tpsa: 49.81
Logp: 2.81268
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄ClF₃N₂
Molecular Weight:
220.58
Synonyms:
None
SMILES:
N#CC1=CC(N)=C(Cl)C=C1C(F)(F)F
Tpsa:
49.81
Logp:
2.81268
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄BrFN₂
Molecular Weight: 215.02
Synonyms: None
SMILES: FC1=C(Br)C=CC2=CN=CN12
Tpsa: 17.3
Logp: 2.2359
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₄BrFN₂
Molecular Weight:
215.02
Synonyms:
None
SMILES:
FC1=C(Br)C=CC2=CN=CN12
Tpsa:
17.3
Logp:
2.2359
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0