CS-0766685
4-(3-Bromo-2-Trifluoromethylphenyl)-4-oxo-butyric acid
Manufacturer: ChemScene
CAS Number: 1416373-70-0
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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
C₁₁H₈BrF₃O₃
Molecular Weight
325.08
Synonyms
None
SMILES
OC(=O)CCC(=O)C1=C(C(Br)=CC=C1)C(F)(F)F
Tpsa
54.37
Logp
3.5154
H Acceptors
2
H Donors
1
Rotatable Bonds
4
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: C₁₁H₈BrF₃O₃
Molecular Weight: 325.08
Synonyms: None
SMILES: OC(=O)CCC(=O)C1=C(C(Br)=CC=C1)C(F)(F)F
Tpsa: 54.37
Logp: 3.5154
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₈BrF₃O₃
Molecular Weight:
325.08
Synonyms:
None
SMILES:
OC(=O)CCC(=O)C1=C(C(Br)=CC=C1)C(F)(F)F
Tpsa:
54.37
Logp:
3.5154
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉BrN₂
Molecular Weight: 201.06
Synonyms: None
SMILES: CN1C(Br)=CN=C1C1CC1
Tpsa: 17.82
Logp: 2.06
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉BrN₂
Molecular Weight:
201.06
Synonyms:
None
SMILES:
CN1C(Br)=CN=C1C1CC1
Tpsa:
17.82
Logp:
2.06
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀N₂O₃
Molecular Weight: 182.18
Synonyms: None
SMILES: CCCOC(=O)C1=NC=C(O)C=N1
Tpsa: 72.31
Logp: 0.749
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀N₂O₃
Molecular Weight:
182.18
Synonyms:
None
SMILES:
CCCOC(=O)C1=NC=C(O)C=N1
Tpsa:
72.31
Logp:
0.749
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₉N₃O₂
Molecular Weight: 227.22
Synonyms: None
SMILES: O=C1N(CC2=CC=NN2)C(=O)C2=CC=CC=C12
Tpsa: 66.06
Logp: 1.2059
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:
C₁₂H₉N₃O₂
Molecular Weight:
227.22
Synonyms:
None
SMILES:
O=C1N(CC2=CC=NN2)C(=O)C2=CC=CC=C12
Tpsa:
66.06
Logp:
1.2059
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2