CS-0998915
5-Neopentylisoxazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 943925-81-3
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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
C₉H₁₃NO₃
Molecular Weight
183.20
Synonyms
None
SMILES
O=C(C1=NOC(CC(C)(C)C)=C1)O
Tpsa
63.33
Logp
1.9614
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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: C₉H₁₃NO₃
Molecular Weight: 183.20
Synonyms: None
SMILES: O=C(C1=NOC(CC(C)(C)C)=C1)O
Tpsa: 63.33
Logp: 1.9614
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:
C₉H₁₃NO₃
Molecular Weight:
183.20
Synonyms:
None
SMILES:
O=C(C1=NOC(CC(C)(C)C)=C1)O
Tpsa:
63.33
Logp:
1.9614
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: C₇H₇BF₃NO₂
Molecular Weight: 204.94
Synonyms: None
SMILES: FC(F)(F)C1=CN=C(B(O)O)C(=C1)C
Tpsa: 53.35
Logp: 0.08862
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:
C₇H₇BF₃NO₂
Molecular Weight:
204.94
Synonyms:
None
SMILES:
FC(F)(F)C1=CN=C(B(O)O)C(=C1)C
Tpsa:
53.35
Logp:
0.08862
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: C₇H₆BClF₂O₂
Molecular Weight: 206.38
Synonyms: None
SMILES: FC(F)C1=CC(Cl)=CC=C1B(O)O
Tpsa: 40.46
Logp: 0.9574
H Acceptors: 2
H Donors: 2
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:
C₇H₆BClF₂O₂
Molecular Weight:
206.38
Synonyms:
None
SMILES:
FC(F)C1=CC(Cl)=CC=C1B(O)O
Tpsa:
40.46
Logp:
0.9574
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁NO₂
Molecular Weight: 153.18
Synonyms: None
SMILES: O=CC1=CC(CC(C)C)=NO1
Tpsa: 43.1
Logp: 1.6856
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₁NO₂
Molecular Weight:
153.18
Synonyms:
None
SMILES:
O=CC1=CC(CC(C)C)=NO1
Tpsa:
43.1
Logp:
1.6856
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3