CS-0612648
2-(5-Methyl-4-nitroisoxazol-3-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 960224-76-4
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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
C₆H₆N₂O₅
Molecular Weight
186.12
Synonyms
(5-Methyl-4-nitro-1,2-oxazol-3-yl)acetic acid
SMILES
O=C(O)CC1=NOC(C)=C1[N+]([O-])=O
Tpsa
106.47
Logp
0.51832
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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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: C₆H₆N₂O₅
Molecular Weight: 186.12
Synonyms: (5-Methyl-4-nitro-1,2-oxazol-3-yl)acetic acid
SMILES: O=C(O)CC1=NOC(C)=C1[N+]([O-])=O
Tpsa: 106.47
Logp: 0.51832
H Acceptors: 5
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:
C₆H₆N₂O₅
Molecular Weight:
186.12
Synonyms:
(5-Methyl-4-nitro-1,2-oxazol-3-yl)acetic acid
SMILES:
O=C(O)CC1=NOC(C)=C1[N+]([O-])=O
Tpsa:
106.47
Logp:
0.51832
H Acceptors:
5
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: C₇H₉FN₂
Molecular Weight: 140.16
Synonyms: None
SMILES: NCCC1=NC(F)=CC=C1
Tpsa: 38.91
Logp: 0.7219
H Acceptors: 2
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:
C₇H₉FN₂
Molecular Weight:
140.16
Synonyms:
None
SMILES:
NCCC1=NC(F)=CC=C1
Tpsa:
38.91
Logp:
0.7219
H Acceptors:
2
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: C₅H₄N₂O₅
Molecular Weight: 172.10
Synonyms: None
SMILES: O=C(C1=C([N+]([O-])=O)C(C)=NO1)O
Tpsa: 106.47
Logp: 0.58942
H Acceptors: 5
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:
C₅H₄N₂O₅
Molecular Weight:
172.10
Synonyms:
None
SMILES:
O=C(C1=C([N+]([O-])=O)C(C)=NO1)O
Tpsa:
106.47
Logp:
0.58942
H Acceptors:
5
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: C₁₃H₂₁NO₅
Molecular Weight: 271.31
Synonyms: None
SMILES: CC(C)(OC(N[C@H](C(O)=O)C1CCC(CC1)=O)=O)C
Tpsa: 92.7
Logp: 1.7236
H Acceptors: 4
H Donors: 2
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:
C₁₃H₂₁NO₅
Molecular Weight:
271.31
Synonyms:
None
SMILES:
CC(C)(OC(N[C@H](C(O)=O)C1CCC(CC1)=O)=O)C
Tpsa:
92.7
Logp:
1.7236
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3