CS-0539856
(3R,5S)-6'-bromo-4-methoxy-3,5-dimethylspiro[cyclohexane-1,2'-inden]-1'(3'H)-one
Manufacturer: ChemScene
CAS Number: 1454700-89-0
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₂₁BrO₂
Molecular Weight
337.25
Synonyms
(1r,3R,4r,5S)-6'-Bromo-4-methoxy-3,5-dimethylspiro[cyclohexane-1,2'-inden]-1'(3'H)-one
SMILES
C[C@@H]1CC2(C[C@@H](C1OC)C)CC3=C(C2=O)C=C(C=C3)Br
Tpsa
26.3
Logp
4.2553
H Acceptors
2
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1454700-89-0 | IN00076730 | A2B Chem | -- |
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
Compare Similar Items
Show Difference
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₁BrO₂
Molecular Weight: 337.25
Synonyms: (1r,3R,4r,5S)-6'-Bromo-4-methoxy-3,5-dimethylspiro[cyclohexane-1,2'-inden]-1'(3'H)-one
SMILES: C[C@@H]1CC2(C[C@@H](C1OC)C)CC3=C(C2=O)C=C(C=C3)Br
Tpsa: 26.3
Logp: 4.2553
H Acceptors: 2
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:
C₁₇H₂₁BrO₂
Molecular Weight:
337.25
Synonyms:
(1r,3R,4r,5S)-6'-Bromo-4-methoxy-3,5-dimethylspiro[cyclohexane-1,2'-inden]-1'(3'H)-one
SMILES:
C[C@@H]1CC2(C[C@@H](C1OC)C)CC3=C(C2=O)C=C(C=C3)Br
Tpsa:
26.3
Logp:
4.2553
H Acceptors:
2
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: C₁₈H₂₅BrO₄
Molecular Weight: 385.29
Synonyms: None
SMILES: [C@]([C@H](C)C1=CC=C(Br)C=C1)(CC(OC(C)(C)C)=O)(C(OC)=O)C
Tpsa: 52.6
Logp: 4.4637
H Acceptors: 4
H Donors: 0
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:
C₁₈H₂₅BrO₄
Molecular Weight:
385.29
Synonyms:
None
SMILES:
[C@]([C@H](C)C1=CC=C(Br)C=C1)(CC(OC(C)(C)C)=O)(C(OC)=O)C
Tpsa:
52.6
Logp:
4.4637
H Acceptors:
4
H Donors:
0
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: C₇H₁₁NO₂
Molecular Weight: 141.17
Synonyms: rel-(3aR,5S)-3,3a,4,5-Tetrahydro-5-methyl-7H-pyrano[3,4-c]isoxazole
SMILES: C[C@@H]1C[C@]2([H])C(CO1)=NOC2
Tpsa: 30.82
Logp: 0.7976
H Acceptors: 3
H Donors: 0
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:
C₇H₁₁NO₂
Molecular Weight:
141.17
Synonyms:
rel-(3aR,5S)-3,3a,4,5-Tetrahydro-5-methyl-7H-pyrano[3,4-c]isoxazole
SMILES:
C[C@@H]1C[C@]2([H])C(CO1)=NOC2
Tpsa:
30.82
Logp:
0.7976
H Acceptors:
3
H Donors:
0
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: C₁₀H₉NO₃
Molecular Weight: 191.18
Synonyms: None
SMILES: CNC(=O)C1=COC2=C1C=CC(=C2)O
Tpsa: 62.47
Logp: 1.498
H Acceptors: 3
H Donors: 2
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:
C₁₀H₉NO₃
Molecular Weight:
191.18
Synonyms:
None
SMILES:
CNC(=O)C1=COC2=C1C=CC(=C2)O
Tpsa:
62.47
Logp:
1.498
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1