CS-0598136
3-(5-Phenylisoxazol-3-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 3919-86-6
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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
C₁₂H₁₁NO₃
Molecular Weight
217.22
Synonyms
None
SMILES
C1=CC=C(C=C1)C2=CC(=NO2)CCC(=O)O
Tpsa
63.33
Logp
2.3588
H Acceptors
3
H Donors
1
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
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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: C₁₂H₁₁NO₃
Molecular Weight: 217.22
Synonyms: None
SMILES: C1=CC=C(C=C1)C2=CC(=NO2)CCC(=O)O
Tpsa: 63.33
Logp: 2.3588
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:
C₁₂H₁₁NO₃
Molecular Weight:
217.22
Synonyms:
None
SMILES:
C1=CC=C(C=C1)C2=CC(=NO2)CCC(=O)O
Tpsa:
63.33
Logp:
2.3588
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: C₇H₁₄N₂O
Molecular Weight: 142.20
Synonyms: None
SMILES: CCN1CCC(=O)NCC1
Tpsa: 32.34
Logp: -0.1718
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:
C₇H₁₄N₂O
Molecular Weight:
142.20
Synonyms:
None
SMILES:
CCN1CCC(=O)NCC1
Tpsa:
32.34
Logp:
-0.1718
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: C₁₃H₁₃ClN₂O
Molecular Weight: 248.71
Synonyms: None
SMILES: C1COCCN1C2=CC(=NC3=CC=CC=C32)Cl
Tpsa: 25.36
Logp: 2.7248
H Acceptors: 3
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:
C₁₃H₁₃ClN₂O
Molecular Weight:
248.71
Synonyms:
None
SMILES:
C1COCCN1C2=CC(=NC3=CC=CC=C32)Cl
Tpsa:
25.36
Logp:
2.7248
H Acceptors:
3
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: C₁₆H₁₃NO₄
Molecular Weight: 283.28
Synonyms: None
SMILES: C1=CC=C(C=C1)OCCON2C(=O)C3=CC=CC=C3C2=O
Tpsa: 55.84
Logp: 2.2932
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:
C₁₆H₁₃NO₄
Molecular Weight:
283.28
Synonyms:
None
SMILES:
C1=CC=C(C=C1)OCCON2C(=O)C3=CC=CC=C3C2=O
Tpsa:
55.84
Logp:
2.2932
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5