CS-0674941
3-(2-Methoxyphenyl)isoxazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1368848-91-2
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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
C₁₁H₉NO₄
Molecular Weight
219.19
Synonyms
None
SMILES
O=C(C1=CON=C1C2=CC=CC=C2OC)O
Tpsa
72.56
Logp
2.0484
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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: C₁₁H₉NO₄
Molecular Weight: 219.19
Synonyms: None
SMILES: O=C(C1=CON=C1C2=CC=CC=C2OC)O
Tpsa: 72.56
Logp: 2.0484
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:
C₁₁H₉NO₄
Molecular Weight:
219.19
Synonyms:
None
SMILES:
O=C(C1=CON=C1C2=CC=CC=C2OC)O
Tpsa:
72.56
Logp:
2.0484
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: C₃₂H₃₃N₃O₇
Molecular Weight: 571.62
Synonyms: None
SMILES: O[C@H]1C[C@H](N2C=CC(NC(C)=O)=NC2=O)O[C@@H]1COC(C3=CC=CC=C3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5
Tpsa: 121.14
Logp: 3.876
H Acceptors: 9
H Donors: 2
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₃₃N₃O₇
Molecular Weight:
571.62
Synonyms:
None
SMILES:
O[C@H]1C[C@H](N2C=CC(NC(C)=O)=NC2=O)O[C@@H]1COC(C3=CC=CC=C3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5
Tpsa:
121.14
Logp:
3.876
H Acceptors:
9
H Donors:
2
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁ClN₂O
Molecular Weight: 174.63
Synonyms: None
SMILES: O=C1N=CC(C(C)C)=CN1.[H]Cl
Tpsa: 45.75
Logp: 1.3151
H Acceptors: 2
H Donors: 1
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:
C₇H₁₁ClN₂O
Molecular Weight:
174.63
Synonyms:
None
SMILES:
O=C1N=CC(C(C)C)=CN1.[H]Cl
Tpsa:
45.75
Logp:
1.3151
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₈O₂
Molecular Weight: 312.45
Synonyms: None
SMILES: C[C@H]1[C@@]2([H])[C@@]3([H])[C@@]([C@@](O)(CC3)C#C)(CC[C@]2([H])[C@]4([H])C(C1)=CC(CC4)=O)C
Tpsa: 37.3
Logp: 3.7385
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₈O₂
Molecular Weight:
312.45
Synonyms:
None
SMILES:
C[C@H]1[C@@]2([H])[C@@]3([H])[C@@]([C@@](O)(CC3)C#C)(CC[C@]2([H])[C@]4([H])C(C1)=CC(CC4)=O)C
Tpsa:
37.3
Logp:
3.7385
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0