CS-0590265
2,2'-Azanediylbis(N-(2,2,2-trifluoroethyl)acetamide) Fluralaner Impurity
Manufacturer: ChemScene
CAS Number: 2248680-88-6
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Purity
98%
MDL No
None
Storage
4°C, protect from light
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₈H₁₁F₆N₃O₂
Molecular Weight
295.18
Synonyms
INDEX NAME NOT YET ASSIGNED
SMILES
O=C(CNCC(NCC(F)(F)F)=O)NCC(F)(F)F
Tpsa
70.23
Logp
-0.067
H Acceptors
3
H Donors
3
Rotatable Bonds
6
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁F₆N₃O₂
Molecular Weight: 295.18
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: O=C(CNCC(NCC(F)(F)F)=O)NCC(F)(F)F
Tpsa: 70.23
Logp: -0.067
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₁F₆N₃O₂
Molecular Weight:
295.18
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
O=C(CNCC(NCC(F)(F)F)=O)NCC(F)(F)F
Tpsa:
70.23
Logp:
-0.067
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD16659121
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₂ClFN₂O
Molecular Weight: 148.52
Synonyms: 2(1H)-Pyrimidinone, 4-chloro-5-fluoro- (8CI,9CI)
SMILES: O=C1N=CC(F)=C(Cl)N1
Tpsa: 45.75
Logp: 0.5624
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD16659121
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₂ClFN₂O
Molecular Weight:
148.52
Synonyms:
2(1H)-Pyrimidinone, 4-chloro-5-fluoro- (8CI,9CI)
SMILES:
O=C1N=CC(F)=C(Cl)N1
Tpsa:
45.75
Logp:
0.5624
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: C₂₄H₃₄O₅
Molecular Weight: 402.52
Synonyms: None
SMILES: O[C@@H](CCC1=CC=CC=C1)/C=C/[C@@H]2[C@H]([C@H](C[C@H]2O)O)C/C=C\CCCC(OC)=O
Tpsa: 86.99
Logp: 3.1838
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₄O₅
Molecular Weight:
402.52
Synonyms:
None
SMILES:
O[C@@H](CCC1=CC=CC=C1)/C=C/[C@@H]2[C@H]([C@H](C[C@H]2O)O)C/C=C\CCCC(OC)=O
Tpsa:
86.99
Logp:
3.1838
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₃F₄IO
Molecular Weight: 306.00
Synonyms: None
SMILES: FC(F)(F)OC1=CC(I)=CC=C1F
Tpsa: 9.23
Logp: 3.3289
H Acceptors: 1
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:
C₇H₃F₄IO
Molecular Weight:
306.00
Synonyms:
None
SMILES:
FC(F)(F)OC1=CC(I)=CC=C1F
Tpsa:
9.23
Logp:
3.3289
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1