CS-0835589
1-(2,3,6-Trifluoro-4-nitrophenyl)-2,3-dihydropyridin-4(1H)-one
Manufacturer: ChemScene
CAS Number: 1112968-93-0
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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
C₁₁H₇F₃N₂O₃
Molecular Weight
272.18
Synonyms
None
SMILES
FC1=C(N2C=CC(CC2)=O)C(F)=CC([N+]([O-])=O)=C1F
Tpsa
63.45
Logp
2.305
H Acceptors
4
H Donors
0
Rotatable Bonds
2
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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: C₁₁H₇F₃N₂O₃
Molecular Weight: 272.18
Synonyms: None
SMILES: FC1=C(N2C=CC(CC2)=O)C(F)=CC([N+]([O-])=O)=C1F
Tpsa: 63.45
Logp: 2.305
H Acceptors: 4
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:
C₁₁H₇F₃N₂O₃
Molecular Weight:
272.18
Synonyms:
None
SMILES:
FC1=C(N2C=CC(CC2)=O)C(F)=CC([N+]([O-])=O)=C1F
Tpsa:
63.45
Logp:
2.305
H Acceptors:
4
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: C₁₂H₈F₃N₂O₃+
Molecular Weight: 285.20
Synonyms: None
SMILES: FC1=C([N+]2=CC=C(OC)C=C2)C(F)=CC([N+]([O-])=O)=C1F
Tpsa: 56.25
Logp: 2.2974
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:
C₁₂H₈F₃N₂O₃+
Molecular Weight:
285.20
Synonyms:
None
SMILES:
FC1=C([N+]2=CC=C(OC)C=C2)C(F)=CC([N+]([O-])=O)=C1F
Tpsa:
56.25
Logp:
2.2974
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: C₉H₁₂N₂O₃
Molecular Weight: 196.20
Synonyms: None
SMILES: O=C(C1=NNC(C(C)=O)=C1C)OCC
Tpsa: 72.05
Logp: 1.09742
H Acceptors: 4
H Donors: 1
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:
C₉H₁₂N₂O₃
Molecular Weight:
196.20
Synonyms:
None
SMILES:
O=C(C1=NNC(C(C)=O)=C1C)OCC
Tpsa:
72.05
Logp:
1.09742
H Acceptors:
4
H Donors:
1
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: C₉H₁₀BrN
Molecular Weight: 212.09
Synonyms: None
SMILES: CC1=CC(Br)=CC2=C1NCC2
Tpsa: 12.03
Logp: 2.72552
H Acceptors: 1
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:
C₉H₁₀BrN
Molecular Weight:
212.09
Synonyms:
None
SMILES:
CC1=CC(Br)=CC2=C1NCC2
Tpsa:
12.03
Logp:
2.72552
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0