CS-0760795
4-(3-Bromo-Phenyl)-3-oxo-butyric acid methyl ester
Manufacturer: ChemScene
CAS Number: 942474-94-4
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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
C₁₁H₁₁BrO₃
Molecular Weight
271.11
Synonyms
None
SMILES
COC(=O)CC(=O)CC1=CC(Br)=CC=C1
Tpsa
43.37
Logp
2.1238
H Acceptors
3
H Donors
0
Rotatable Bonds
4
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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: C₁₁H₁₁BrO₃
Molecular Weight: 271.11
Synonyms: None
SMILES: COC(=O)CC(=O)CC1=CC(Br)=CC=C1
Tpsa: 43.37
Logp: 2.1238
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:
C₁₁H₁₁BrO₃
Molecular Weight:
271.11
Synonyms:
None
SMILES:
COC(=O)CC(=O)CC1=CC(Br)=CC=C1
Tpsa:
43.37
Logp:
2.1238
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: C₁₀H₁₄S
Molecular Weight: 166.28
Synonyms: None
SMILES: CCC1=CC(CC)=CC(S)=C1
Tpsa: 0
Logp: 3.1001
H Acceptors: 1
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:
C₁₀H₁₄S
Molecular Weight:
166.28
Synonyms:
None
SMILES:
CCC1=CC(CC)=CC(S)=C1
Tpsa:
0
Logp:
3.1001
H Acceptors:
1
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: C₁₂H₁₃F₃O
Molecular Weight: 230.23
Synonyms: None
SMILES: CCC1=CC(=CC(CC)=C1)C(=O)C(F)(F)F
Tpsa: 17.07
Logp: 3.5564
H Acceptors: 1
H Donors: 0
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:
C₁₂H₁₃F₃O
Molecular Weight:
230.23
Synonyms:
None
SMILES:
CCC1=CC(=CC(CC)=C1)C(=O)C(F)(F)F
Tpsa:
17.07
Logp:
3.5564
H Acceptors:
1
H Donors:
0
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: C₁₉H₁₉NO₃
Molecular Weight: 309.36
Synonyms: None
SMILES: CC[C@@]1(C)N([C@@H](OC1=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1
Tpsa: 46.61
Logp: 3.5531
H Acceptors: 3
H Donors: 0
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:
C₁₉H₁₉NO₃
Molecular Weight:
309.36
Synonyms:
None
SMILES:
CC[C@@]1(C)N([C@@H](OC1=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1
Tpsa:
46.61
Logp:
3.5531
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3