CS-0616276
Methyl 2-acetyl-5-bromo-4-(trifluoromethyl)benzoate
Manufacturer: ChemScene
CAS Number: 2654747-32-5
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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
C₁₁H₈BrF₃O₃
Molecular Weight
325.08
Synonyms
None
SMILES
O=C(OC)C1=CC(Br)=C(C(F)(F)F)C=C1C(C)=O
Tpsa
43.37
Logp
3.4571
H Acceptors
3
H Donors
0
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: C₁₁H₈BrF₃O₃
Molecular Weight: 325.08
Synonyms: None
SMILES: O=C(OC)C1=CC(Br)=C(C(F)(F)F)C=C1C(C)=O
Tpsa: 43.37
Logp: 3.4571
H Acceptors: 3
H Donors: 0
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:
C₁₁H₈BrF₃O₃
Molecular Weight:
325.08
Synonyms:
None
SMILES:
O=C(OC)C1=CC(Br)=C(C(F)(F)F)C=C1C(C)=O
Tpsa:
43.37
Logp:
3.4571
H Acceptors:
3
H Donors:
0
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: C₁₂H₁₂BrFO₃
Molecular Weight: 303.12
Synonyms: None
SMILES: O=C(OC)C1=CC(Br)=C(F)C=C1C(OCC)=C
Tpsa: 35.53
Logp: 3.382
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂BrFO₃
Molecular Weight:
303.12
Synonyms:
None
SMILES:
O=C(OC)C1=CC(Br)=C(F)C=C1C(OCC)=C
Tpsa:
35.53
Logp:
3.382
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₀N₂O₃
Molecular Weight: 276.33
Synonyms: None
SMILES: O=C(OC(C)(C)C)N[C@@H](C1=CC=CC(C#N)=C1OC)C
Tpsa: 71.35
Logp: 3.15258
H Acceptors: 4
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:
C₁₅H₂₀N₂O₃
Molecular Weight:
276.33
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N[C@@H](C1=CC=CC(C#N)=C1OC)C
Tpsa:
71.35
Logp:
3.15258
H Acceptors:
4
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: C₁₄H₂₀BrNO₃
Molecular Weight: 330.22
Synonyms: None
SMILES: CC(C)(C)OC(N[C@@H](C1=C(C(Br)=CC=C1)OC)C)=O
Tpsa: 47.56
Logp: 4.0434
H Acceptors: 3
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:
C₁₄H₂₀BrNO₃
Molecular Weight:
330.22
Synonyms:
None
SMILES:
CC(C)(C)OC(N[C@@H](C1=C(C(Br)=CC=C1)OC)C)=O
Tpsa:
47.56
Logp:
4.0434
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3