CS-0531435
2-(tert-Butoxy)-2-oxoethyl 2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetate Acemetacin Impurity
Manufacturer: ChemScene
CAS Number: 75302-98-6
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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
C₂₅H₂₆ClNO₆
Molecular Weight
471.93
Synonyms
2-tert-Butoxy-2-oxoethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate
SMILES
O=C(CC1=C(C)N(C(C2=CC=C(C=C2)Cl)=O)C3=C1C=C(C=C3)OC)OCC(OC(C)(C)C)=O
Tpsa
83.83
Logp
4.72762
H Acceptors
7
H Donors
0
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 75302-98-6 | 2-(tert-Butoxy)-2-oxoethyl 2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetate | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/toxic.svg
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
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: C₂₅H₂₆ClNO₆
Molecular Weight: 471.93
Synonyms: 2-tert-Butoxy-2-oxoethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate
SMILES: O=C(CC1=C(C)N(C(C2=CC=C(C=C2)Cl)=O)C3=C1C=C(C=C3)OC)OCC(OC(C)(C)C)=O
Tpsa: 83.83
Logp: 4.72762
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₆ClNO₆
Molecular Weight:
471.93
Synonyms:
2-tert-Butoxy-2-oxoethyl [1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetate
SMILES:
O=C(CC1=C(C)N(C(C2=CC=C(C=C2)Cl)=O)C3=C1C=C(C=C3)OC)OCC(OC(C)(C)C)=O
Tpsa:
83.83
Logp:
4.72762
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₁₇ClO₃
Molecular Weight: 364.82
Synonyms: 3-[4-(4-Chlorophenyl)cyclohex-3-en-1-yl]-4-hydroxynaphthalene-1,2-dione
SMILES: O=C1C(O)=C(C2CC=C(CC2)C3=CC=C(Cl)C=C3)C(C4=C1C=CC=C4)=O
Tpsa: 54.37
Logp: 5.4148
H Acceptors: 3
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:
C₂₂H₁₇ClO₃
Molecular Weight:
364.82
Synonyms:
3-[4-(4-Chlorophenyl)cyclohex-3-en-1-yl]-4-hydroxynaphthalene-1,2-dione
SMILES:
O=C1C(O)=C(C2CC=C(CC2)C3=CC=C(Cl)C=C3)C(C4=C1C=CC=C4)=O
Tpsa:
54.37
Logp:
5.4148
H Acceptors:
3
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: C₁₂H₁₅N₃O₄S
Molecular Weight: 297.33
Synonyms: Sulfamidopyrine
SMILES: O=C1C(NCS(=O)(O)=O)=C(C)N(C)N1C2=CC=CC=C2
Tpsa: 93.33
Logp: 0.74162
H Acceptors: 6
H Donors: 2
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:
C₁₂H₁₅N₃O₄S
Molecular Weight:
297.33
Synonyms:
Sulfamidopyrine
SMILES:
O=C1C(NCS(=O)(O)=O)=C(C)N(C)N1C2=CC=CC=C2
Tpsa:
93.33
Logp:
0.74162
H Acceptors:
6
H Donors:
2
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: C₁₄H₂₃ClN₂O₃S
Molecular Weight: 334.86
Synonyms: Articaine Impurity G
SMILES: O=C(C1=C(NC(C(C)NCCCC)=O)C(C)=CS1)OC.Cl
Tpsa: 67.43
Logp: 2.98162
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₃ClN₂O₃S
Molecular Weight:
334.86
Synonyms:
Articaine Impurity G
SMILES:
O=C(C1=C(NC(C(C)NCCCC)=O)C(C)=CS1)OC.Cl
Tpsa:
67.43
Logp:
2.98162
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
7