CS-0999426
(S)-3-((5,7-Difluorochroman-4-yl)oxy)-N,N-dimethyl-4-nitrobenzamide
Manufacturer: ChemScene
CAS Number: 2648486-30-8
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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
C₁₈H₁₆F₂N₂O₅
Molecular Weight
378.33
Synonyms
None
SMILES
O=C(N(C)C)C1=CC=C([N+]([O-])=O)C(O[C@H]2CCOC3=CC(F)=CC(F)=C23)=C1
Tpsa
81.91
Logp
3.4774
H Acceptors
5
H Donors
0
Rotatable Bonds
4
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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: C₁₈H₁₆F₂N₂O₅
Molecular Weight: 378.33
Synonyms: None
SMILES: O=C(N(C)C)C1=CC=C([N+]([O-])=O)C(O[C@H]2CCOC3=CC(F)=CC(F)=C23)=C1
Tpsa: 81.91
Logp: 3.4774
H Acceptors: 5
H Donors: 0
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:
C₁₈H₁₆F₂N₂O₅
Molecular Weight:
378.33
Synonyms:
None
SMILES:
O=C(N(C)C)C1=CC=C([N+]([O-])=O)C(O[C@H]2CCOC3=CC(F)=CC(F)=C23)=C1
Tpsa:
81.91
Logp:
3.4774
H Acceptors:
5
H Donors:
0
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: C₁₈H₁₈F₂N₂O₃
Molecular Weight: 348.34
Synonyms: None
SMILES: FC1=C2C(OCC[C@@H]2OC3=CC(C(N(C)C)=O)=CC=C3N)=CC(F)=C1
Tpsa: 64.79
Logp: 3.1514
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:
C₁₈H₁₈F₂N₂O₃
Molecular Weight:
348.34
Synonyms:
None
SMILES:
FC1=C2C(OCC[C@@H]2OC3=CC(C(N(C)C)=O)=CC=C3N)=CC(F)=C1
Tpsa:
64.79
Logp:
3.1514
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: 4°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: None
Molecular Weight: None
Synonyms: None
SMILES: OC(C(SC(SCCC(O)=O)=S)CC(C)C(O)=O)=O.[n]
Tpsa: 142.4
Logp: 1.2958
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
4°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
None
Molecular Weight:
None
Synonyms:
None
SMILES:
OC(C(SC(SCCC(O)=O)=S)CC(C)C(O)=O)=O.[n]
Tpsa:
142.4
Logp:
1.2958
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₉NO₄
Molecular Weight: 337.37
Synonyms: None
SMILES: O=C(N1[C@@](C)(CC1)C(O)=O)OCC2C3=CC=CC=C3C4=CC=CC=C42
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₉NO₄
Molecular Weight:
337.37
Synonyms:
None
SMILES:
O=C(N1[C@@](C)(CC1)C(O)=O)OCC2C3=CC=CC=C3C4=CC=CC=C42
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A