CS-1075911
Tert-butyl 4-(5-methylisoxazol-3-yl)-4-oxobutanoate
Manufacturer: ChemScene
CAS Number: 2688735-34-2
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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
C₁₂H₁₇NO₄
Molecular Weight
239.27
Synonyms
None
SMILES
O=C(OC(C)(C)C)CCC(=O)C1=NOC(=C1)C
Tpsa
69.4
Logp
2.28762
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: C₁₂H₁₇NO₄
Molecular Weight: 239.27
Synonyms: None
SMILES: O=C(OC(C)(C)C)CCC(=O)C1=NOC(=C1)C
Tpsa: 69.4
Logp: 2.28762
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:
C₁₂H₁₇NO₄
Molecular Weight:
239.27
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CCC(=O)C1=NOC(=C1)C
Tpsa:
69.4
Logp:
2.28762
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: C₁₂H₄BrF₄N₃OS
Molecular Weight: 394.14
Synonyms: None
SMILES: N#CC=1C(=O)NC(=S)NC1C=2C(F)=CC=C(C2Br)C(F)(F)F
Tpsa: 72.44
Logp: 3.89157
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:
C₁₂H₄BrF₄N₃OS
Molecular Weight:
394.14
Synonyms:
None
SMILES:
N#CC=1C(=O)NC(=S)NC1C=2C(F)=CC=C(C2Br)C(F)(F)F
Tpsa:
72.44
Logp:
3.89157
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: C₁₁H₁₁FO₄
Molecular Weight: 226.20
Synonyms: None
SMILES: O=C(OC)C(F)C1C2=CC=C(O)C=C2OC1
Tpsa: 55.76
Logp: 1.3793
H Acceptors: 4
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:
C₁₁H₁₁FO₄
Molecular Weight:
226.20
Synonyms:
None
SMILES:
O=C(OC)C(F)C1C2=CC=C(O)C=C2OC1
Tpsa:
55.76
Logp:
1.3793
H Acceptors:
4
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: C₁₁H₁₀F₂O₄
Molecular Weight: 244.19
Synonyms: None
SMILES: O=C(OC)C(F)(F)C1C2=CC=C(O)C=C2OC1
Tpsa: 55.76
Logp: 1.6765
H Acceptors: 4
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:
C₁₁H₁₀F₂O₄
Molecular Weight:
244.19
Synonyms:
None
SMILES:
O=C(OC)C(F)(F)C1C2=CC=C(O)C=C2OC1
Tpsa:
55.76
Logp:
1.6765
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2