CS-0542721
(5R,8aS)-3-(4-methoxyphenyl)-3a,7,8,8a-tetrahydro-5,8-epoxyoxepino[4,5-d]isoxazol-4(5H)-one
Manufacturer: ChemScene
CAS Number: 1212428-47-1
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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
C₁₄H₁₃NO₅
Molecular Weight
275.26
Synonyms
None
SMILES
COC1=CC=C(C=C1)C2=NO[C@H]3C2C(=O)[C@@H]4OCC3O4
Tpsa
66.35
Logp
0.7385
H Acceptors
6
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1212428-47-1 | (2S,8R)-5-(4-Methoxy-phenyl)-3,9,11-trioxa-4-aza-tricyclo[6.2.1.0*2,6*]undec-4-en-7-one | A2B Chem | -- |
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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: C₁₄H₁₃NO₅
Molecular Weight: 275.26
Synonyms: None
SMILES: COC1=CC=C(C=C1)C2=NO[C@H]3C2C(=O)[C@@H]4OCC3O4
Tpsa: 66.35
Logp: 0.7385
H Acceptors: 6
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:
C₁₄H₁₃NO₅
Molecular Weight:
275.26
Synonyms:
None
SMILES:
COC1=CC=C(C=C1)C2=NO[C@H]3C2C(=O)[C@@H]4OCC3O4
Tpsa:
66.35
Logp:
0.7385
H Acceptors:
6
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: C₇H₉NO₄S₃
Molecular Weight: 267.35
Synonyms: None
SMILES: C1[C@H]2[C@@H](CS1(=O)=O)SC(=N2)SCC(=O)O
Tpsa: 83.8
Logp: 0.0726
H Acceptors: 6
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:
C₇H₉NO₄S₃
Molecular Weight:
267.35
Synonyms:
None
SMILES:
C1[C@H]2[C@@H](CS1(=O)=O)SC(=N2)SCC(=O)O
Tpsa:
83.8
Logp:
0.0726
H Acceptors:
6
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: C₁₂H₂₂N₂O₂
Molecular Weight: 226.32
Synonyms: None
SMILES: COCCN1[C@@H]2CCC[C@]2(CCC1=O)CN
Tpsa: 55.56
Logp: 0.7528
H Acceptors: 3
H Donors: 1
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:
C₁₂H₂₂N₂O₂
Molecular Weight:
226.32
Synonyms:
None
SMILES:
COCCN1[C@@H]2CCC[C@]2(CCC1=O)CN
Tpsa:
55.56
Logp:
0.7528
H Acceptors:
3
H Donors:
1
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: C₂₀H₂₈N₂O₅
Molecular Weight: 376.45
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1C[C@H]([C@@H]2[C@H]1CCCO2)NC(=O)OCC3=CC=CC=C3
Tpsa: 77.1
Logp: 3.0797
H Acceptors: 5
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:
C₂₀H₂₈N₂O₅
Molecular Weight:
376.45
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1C[C@H]([C@@H]2[C@H]1CCCO2)NC(=O)OCC3=CC=CC=C3
Tpsa:
77.1
Logp:
3.0797
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3