CS-1097897
3-Oxo-3-(6-(trifluoromethyl)pyridin-2-yl)propanenitrile
Manufacturer: ChemScene
CAS Number: 2090310-04-4
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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
C₉H₅F₃N₂O
Molecular Weight
214.14
Synonyms
None
SMILES
N#CCC(C1=NC(C(F)(F)F)=CC=C1)=O
Tpsa
53.75
Logp
2.19678
H Acceptors
3
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: C₉H₅F₃N₂O
Molecular Weight: 214.14
Synonyms: None
SMILES: N#CCC(C1=NC(C(F)(F)F)=CC=C1)=O
Tpsa: 53.75
Logp: 2.19678
H Acceptors: 3
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:
C₉H₅F₃N₂O
Molecular Weight:
214.14
Synonyms:
None
SMILES:
N#CCC(C1=NC(C(F)(F)F)=CC=C1)=O
Tpsa:
53.75
Logp:
2.19678
H Acceptors:
3
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: C₁₆H₂₈N₂O₈Se₂
Molecular Weight: 534.32
Synonyms: None
SMILES: CC(C)(C)OC(N[C@H](C(O)=O)C[Se][Se]C[C@@H](C(O)=O)NC(OC(C)(C)C)=O)=O
Tpsa: 151.26
Logp: 1.1022
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₈N₂O₈Se₂
Molecular Weight:
534.32
Synonyms:
None
SMILES:
CC(C)(C)OC(N[C@H](C(O)=O)C[Se][Se]C[C@@H](C(O)=O)NC(OC(C)(C)C)=O)=O
Tpsa:
151.26
Logp:
1.1022
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₃ClFNO₂
Molecular Weight: 305.73
Synonyms: None
SMILES: O=C1N(CC2=CC=C(OC)C=C2)CC3=C1C(F)=CC(Cl)=C3
Tpsa: 29.54
Logp: 3.6437
H Acceptors: 2
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:
C₁₆H₁₃ClFNO₂
Molecular Weight:
305.73
Synonyms:
None
SMILES:
O=C1N(CC2=CC=C(OC)C=C2)CC3=C1C(F)=CC(Cl)=C3
Tpsa:
29.54
Logp:
3.6437
H Acceptors:
2
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: C₇H₇BrFNO₂S
Molecular Weight: 268.10
Synonyms: None
SMILES: O=S(C1=CC=C(F)C=C1CBr)(N)=O
Tpsa: 60.16
Logp: 1.368
H Acceptors: 2
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:
C₇H₇BrFNO₂S
Molecular Weight:
268.10
Synonyms:
None
SMILES:
O=S(C1=CC=C(F)C=C1CBr)(N)=O
Tpsa:
60.16
Logp:
1.368
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2