CS-0865690
4-Chloro-5-methylisoxazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 524729-12-2
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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
C₅H₄ClNO₃
Molecular Weight
161.54
Synonyms
None
SMILES
O=C(C1=NOC(C)=C1Cl)O
Tpsa
63.33
Logp
1.33462
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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: C₅H₄ClNO₃
Molecular Weight: 161.54
Synonyms: None
SMILES: O=C(C1=NOC(C)=C1Cl)O
Tpsa: 63.33
Logp: 1.33462
H Acceptors: 3
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:
C₅H₄ClNO₃
Molecular Weight:
161.54
Synonyms:
None
SMILES:
O=C(C1=NOC(C)=C1Cl)O
Tpsa:
63.33
Logp:
1.33462
H Acceptors:
3
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: C₇H₆BrF₂NO
Molecular Weight: 238.03
Synonyms: None
SMILES: FC(F)COC1=NC=C(Br)C=C1
Tpsa: 22.12
Logp: 2.488
H Acceptors: 2
H Donors: 0
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:
C₇H₆BrF₂NO
Molecular Weight:
238.03
Synonyms:
None
SMILES:
FC(F)COC1=NC=C(Br)C=C1
Tpsa:
22.12
Logp:
2.488
H Acceptors:
2
H Donors:
0
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: C₅H₅Cl₂NO
Molecular Weight: 166.01
Synonyms: None
SMILES: CC1=C(Cl)C(CCl)=NO1
Tpsa: 26.03
Logp: 2.37522
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:
C₅H₅Cl₂NO
Molecular Weight:
166.01
Synonyms:
None
SMILES:
CC1=C(Cl)C(CCl)=NO1
Tpsa:
26.03
Logp:
2.37522
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: C₁₂H₁₂F₂O₂
Molecular Weight: 226.22
Synonyms: None
SMILES: O=C(O)C1=CC(C(F)(F)C)=CC(C2CC2)=C1
Tpsa: 37.3
Logp: 3.3739
H Acceptors: 1
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:
C₁₂H₁₂F₂O₂
Molecular Weight:
226.22
Synonyms:
None
SMILES:
O=C(O)C1=CC(C(F)(F)C)=CC(C2CC2)=C1
Tpsa:
37.3
Logp:
3.3739
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
3