CS-0645345
5-Bromo-2-oxo-6-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 1780644-75-8
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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
C₇H₂BrF₃N₂O
Molecular Weight
267.00
Synonyms
None
SMILES
N#CC1=CC(Br)=C(C(F)(F)F)NC1=O
Tpsa
56.65
Logp
2.02788
H Acceptors
2
H Donors
1
Rotatable Bonds
0
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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
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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: C₇H₂BrF₃N₂O
Molecular Weight: 267.00
Synonyms: None
SMILES: N#CC1=CC(Br)=C(C(F)(F)F)NC1=O
Tpsa: 56.65
Logp: 2.02788
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:
C₇H₂BrF₃N₂O
Molecular Weight:
267.00
Synonyms:
None
SMILES:
N#CC1=CC(Br)=C(C(F)(F)F)NC1=O
Tpsa:
56.65
Logp:
2.02788
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: C₁₃H₁₅ClO₂
Molecular Weight: 238.71
Synonyms: None
SMILES: O=C(C(CC1=CC(Cl)=CC=C1)(C2CC2)C)O
Tpsa: 37.3
Logp: 3.3834
H Acceptors: 1
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:
C₁₃H₁₅ClO₂
Molecular Weight:
238.71
Synonyms:
None
SMILES:
O=C(C(CC1=CC(Cl)=CC=C1)(C2CC2)C)O
Tpsa:
37.3
Logp:
3.3834
H Acceptors:
1
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: C₁₄H₂₂BNO₄S
Molecular Weight: 311.20
Synonyms: None
SMILES: CS(=O)(NCC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)=O
Tpsa: 64.63
Logp: 1.035
H Acceptors: 4
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:
C₁₄H₂₂BNO₄S
Molecular Weight:
311.20
Synonyms:
None
SMILES:
CS(=O)(NCC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)=O
Tpsa:
64.63
Logp:
1.035
H Acceptors:
4
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: C₁₃H₁₄BF₃N₂O₃
Molecular Weight: 314.07
Synonyms: None
SMILES: N#CC1=CC(B2OC(C)(C)C(C)(C)O2)=C(C(F)(F)F)NC1=O
Tpsa: 75.11
Logp: 1.56458
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:
C₁₃H₁₄BF₃N₂O₃
Molecular Weight:
314.07
Synonyms:
None
SMILES:
N#CC1=CC(B2OC(C)(C)C(C)(C)O2)=C(C(F)(F)F)NC1=O
Tpsa:
75.11
Logp:
1.56458
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1