CS-1055330
2-(5-(Tert-butyl)isoxazol-3-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 57612-88-1
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Purity
95%
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(O)CC1=NOC(=C1)C(C)(C)C
Tpsa
63.33
Logp
1.5992
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: 95%
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(O)CC1=NOC(=C1)C(C)(C)C
Tpsa: 63.33
Logp: 1.5992
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
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(O)CC1=NOC(=C1)C(C)(C)C
Tpsa:
63.33
Logp:
1.5992
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: C₇H₆ClF₃N₂
Molecular Weight: 210.58
Synonyms: None
SMILES: NCC1=CC(Cl)=C(C(F)(F)F)N=C1
Tpsa: 38.91
Logp: 2.2125
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:
C₇H₆ClF₃N₂
Molecular Weight:
210.58
Synonyms:
None
SMILES:
NCC1=CC(Cl)=C(C(F)(F)F)N=C1
Tpsa:
38.91
Logp:
2.2125
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃NO
Molecular Weight: 187.24
Synonyms: None
SMILES: O=C1C=C(N(C=2C1=CC=CC2C)C)C
Tpsa: 22
Logp: 2.15534
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃NO
Molecular Weight:
187.24
Synonyms:
None
SMILES:
O=C1C=C(N(C=2C1=CC=CC2C)C)C
Tpsa:
22
Logp:
2.15534
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅ClO₂
Molecular Weight: 168.58
Synonyms: None
SMILES: ClC1=C(O)C=CC=2OC=CC12
Tpsa: 33.37
Logp: 2.7918
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅ClO₂
Molecular Weight:
168.58
Synonyms:
None
SMILES:
ClC1=C(O)C=CC=2OC=CC12
Tpsa:
33.37
Logp:
2.7918
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0