CS-0762155
3-Oxo-4-(2-Trifluoromethyl-phenyl)-butyric acid ethyl ester
Manufacturer: ChemScene
CAS Number: 1048916-57-9
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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
C₁₃H₁₃F₃O₃
Molecular Weight
274.24
Synonyms
None
SMILES
CCOC(=O)CC(=O)CC1=CC=CC=C1C(F)(F)F
Tpsa
43.37
Logp
2.7702
H Acceptors
3
H Donors
0
Rotatable Bonds
5
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: C₁₃H₁₃F₃O₃
Molecular Weight: 274.24
Synonyms: None
SMILES: CCOC(=O)CC(=O)CC1=CC=CC=C1C(F)(F)F
Tpsa: 43.37
Logp: 2.7702
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃F₃O₃
Molecular Weight:
274.24
Synonyms:
None
SMILES:
CCOC(=O)CC(=O)CC1=CC=CC=C1C(F)(F)F
Tpsa:
43.37
Logp:
2.7702
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃N
Molecular Weight: 159.23
Synonyms: None
SMILES: CC1=CC(C)=C(NCC#C)C=C1
Tpsa: 12.03
Logp: 2.34854
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:
C₁₁H₁₃N
Molecular Weight:
159.23
Synonyms:
None
SMILES:
CC1=CC(C)=C(NCC#C)C=C1
Tpsa:
12.03
Logp:
2.34854
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: C₁₁H₁₀F₃N
Molecular Weight: 213.20
Synonyms: None
SMILES: CC1=C(NCC#C)C=CC=C1C(F)(F)F
Tpsa: 12.03
Logp: 3.05892
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:
C₁₁H₁₀F₃N
Molecular Weight:
213.20
Synonyms:
None
SMILES:
CC1=C(NCC#C)C=CC=C1C(F)(F)F
Tpsa:
12.03
Logp:
3.05892
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: C₁₁H₁₃N₃
Molecular Weight: 187.24
Synonyms: None
SMILES: CC1=CC(=NN1)C1=C(N)C=CC(C)=C1
Tpsa: 54.7
Logp: 2.27574
H Acceptors: 2
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:
C₁₁H₁₃N₃
Molecular Weight:
187.24
Synonyms:
None
SMILES:
CC1=CC(=NN1)C1=C(N)C=CC(C)=C1
Tpsa:
54.7
Logp:
2.27574
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1