CS-0311091
5-Chloro-2-(2-ethoxy-2-oxoethyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1227253-51-1
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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
C₁₁H₁₁ClO₄
Molecular Weight
242.66
Synonyms
Benzeneacetic acid, 2-carboxy-4-chloro-, 1-ethyl ester
SMILES
O=C(C1=CC(Cl)=CC=C1CC(OCC)=O)O
Tpsa
63.6
Logp
2.1438
H Acceptors
3
H Donors
1
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
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: C₁₁H₁₁ClO₄
Molecular Weight: 242.66
Synonyms: Benzeneacetic acid, 2-carboxy-4-chloro-, 1-ethyl ester
SMILES: O=C(C1=CC(Cl)=CC=C1CC(OCC)=O)O
Tpsa: 63.6
Logp: 2.1438
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₁ClO₄
Molecular Weight:
242.66
Synonyms:
Benzeneacetic acid, 2-carboxy-4-chloro-, 1-ethyl ester
SMILES:
O=C(C1=CC(Cl)=CC=C1CC(OCC)=O)O
Tpsa:
63.6
Logp:
2.1438
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆FNO₂
Molecular Weight: 179.15
Synonyms: 4-Cyano-2-fluorophenylacetic acid
SMILES: O=C(O)CC1=CC=C(C#N)C=C1F
Tpsa: 61.09
Logp: 1.32448
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆FNO₂
Molecular Weight:
179.15
Synonyms:
4-Cyano-2-fluorophenylacetic acid
SMILES:
O=C(O)CC1=CC=C(C#N)C=C1F
Tpsa:
61.09
Logp:
1.32448
H Acceptors:
2
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: C₁₁H₁₁ClO₃
Molecular Weight: 226.66
Synonyms: Benzeneacetic acid, 4-chloro-2-formyl-, ethyl ester
SMILES: O=C(OCC)CC1=CC=C(Cl)C=C1C=O
Tpsa: 43.37
Logp: 2.2581
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:
C₁₁H₁₁ClO₃
Molecular Weight:
226.66
Synonyms:
Benzeneacetic acid, 4-chloro-2-formyl-, ethyl ester
SMILES:
O=C(OCC)CC1=CC=C(Cl)C=C1C=O
Tpsa:
43.37
Logp:
2.2581
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD06797502
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂FN₃O₂
Molecular Weight: 237.23
Synonyms: 1H-Pyrazolo[3,4-b]pyridine-3-carboxylic acid, 6-fluoro-, 1,1-dimethylethyl ester
SMILES: O=C(C1=NNC2=NC(F)=CC=C21)OC(C)(C)C
Tpsa: 67.87
Logp: 2.0523
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD06797502
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂FN₃O₂
Molecular Weight:
237.23
Synonyms:
1H-Pyrazolo[3,4-b]pyridine-3-carboxylic acid, 6-fluoro-, 1,1-dimethylethyl ester
SMILES:
O=C(C1=NNC2=NC(F)=CC=C21)OC(C)(C)C
Tpsa:
67.87
Logp:
2.0523
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1