CS-0655214
(3aR,4R,5R,6aS)-5-(Benzoyloxy)-4-[(1E)-3,3-difluoro-4-phenoxy-1-buten-1-yl]hexahydro-2H-cyclopenta[b]furan-2-one
Manufacturer: ChemScene
CAS Number: 209861-00-7
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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
C₂₄H₂₂F₂O₅
Molecular Weight
428.43
Synonyms
None
SMILES
O=C1C[C@@]([C@@H](/C=C/C(F)(F)COC2=CC=CC=C2)[C@H](OC(C3=CC=CC=C3)=O)C4)([H])[C@@]4([H])O1
Tpsa
61.83
Logp
4.4341
H Acceptors
5
H Donors
0
Rotatable Bonds
7
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 209861-00-7 | (3aR,4R,5R,6aS)-4-((E)-3,3-Difluoro-4-phenoxybut-1-en-1-yl)-2-oxohexahydro-2H-cyclopenta[b]furan-5-yl benzoate | A2B Chem | -- |
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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
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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: C₂₄H₂₂F₂O₅
Molecular Weight: 428.43
Synonyms: None
SMILES: O=C1C[C@@]([C@@H](/C=C/C(F)(F)COC2=CC=CC=C2)[C@H](OC(C3=CC=CC=C3)=O)C4)([H])[C@@]4([H])O1
Tpsa: 61.83
Logp: 4.4341
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₂F₂O₅
Molecular Weight:
428.43
Synonyms:
None
SMILES:
O=C1C[C@@]([C@@H](/C=C/C(F)(F)COC2=CC=CC=C2)[C@H](OC(C3=CC=CC=C3)=O)C4)([H])[C@@]4([H])O1
Tpsa:
61.83
Logp:
4.4341
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
7
Purity: 97%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₉BrN₂O₂S
Molecular Weight: 347.27
Synonyms: None
SMILES: O=C(N1CCC(C2=NC=C(Br)S2)CC1)OC(C)(C)C
Tpsa: 42.43
Logp: 4.0201
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₉BrN₂O₂S
Molecular Weight:
347.27
Synonyms:
None
SMILES:
O=C(N1CCC(C2=NC=C(Br)S2)CC1)OC(C)(C)C
Tpsa:
42.43
Logp:
4.0201
H Acceptors:
4
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: C₂₅H₃₇NO₄
Molecular Weight: 415.57
Synonyms: None
SMILES: O=C(NCC)CCC/C=C/C[C@@H]1[C@@H](/C=C/[C@H](O)CCC2=CC=CC=C2)[C@H](O)C[C@@H]1O
Tpsa: 89.79
Logp: 3.1469
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₇NO₄
Molecular Weight:
415.57
Synonyms:
None
SMILES:
O=C(NCC)CCC/C=C/C[C@@H]1[C@@H](/C=C/[C@H](O)CCC2=CC=CC=C2)[C@H](O)C[C@@H]1O
Tpsa:
89.79
Logp:
3.1469
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₄₀O₃
Molecular Weight: 412.60
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@H](O)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa: 60.69
Logp: 5.0906
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₄₀O₃
Molecular Weight:
412.60
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@H](O)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa:
60.69
Logp:
5.0906
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
5