CS-0541478
4-(2,2,2-Trifluoroethyl)isoxazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2735655-28-2
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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
C₆H₄F₃NO₃
Molecular Weight
195.10
Synonyms
None
SMILES
O=C(C1=NOC=C1CC(F)(F)F)O
Tpsa
63.33
Logp
1.4776
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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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: C₆H₄F₃NO₃
Molecular Weight: 195.10
Synonyms: None
SMILES: O=C(C1=NOC=C1CC(F)(F)F)O
Tpsa: 63.33
Logp: 1.4776
H Acceptors: 3
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:
C₆H₄F₃NO₃
Molecular Weight:
195.10
Synonyms:
None
SMILES:
O=C(C1=NOC=C1CC(F)(F)F)O
Tpsa:
63.33
Logp:
1.4776
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD09908012
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₁ClO
Molecular Weight: 122.59
Synonyms: 3-CHLORO-2-METHYL-2-BUTANOL
SMILES: ClC(C(C)(C)O)C
Tpsa: 20.23
Logp: 1.3846
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD09908012
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₁ClO
Molecular Weight:
122.59
Synonyms:
3-CHLORO-2-METHYL-2-BUTANOL
SMILES:
ClC(C(C)(C)O)C
Tpsa:
20.23
Logp:
1.3846
H Acceptors:
1
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: C₅H₉NO₃
Molecular Weight: 131.13
Synonyms: None
SMILES: OC[C@H]1[C@H](OC(N1)=O)C
Tpsa: 58.56
Logp: -0.5244
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:
C₅H₉NO₃
Molecular Weight:
131.13
Synonyms:
None
SMILES:
OC[C@H]1[C@H](OC(N1)=O)C
Tpsa:
58.56
Logp:
-0.5244
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: C₅H₇NO₄
Molecular Weight: 145.11
Synonyms: (4S,5S)-5-methyl-2-oxo-1,3-oxazinane-4-carboxylic acid
SMILES: OC([C@H]1NC(O[C@H]1C)=O)=O
Tpsa: 75.63
Logp: -0.4321
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:
C₅H₇NO₄
Molecular Weight:
145.11
Synonyms:
(4S,5S)-5-methyl-2-oxo-1,3-oxazinane-4-carboxylic acid
SMILES:
OC([C@H]1NC(O[C@H]1C)=O)=O
Tpsa:
75.63
Logp:
-0.4321
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1