CS-1001573
Sertraline Impurity 28
Manufacturer: ChemScene
CAS Number: 1498236-91-1
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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
C₁₆H₁₄Cl₂O
Molecular Weight
293.19
Synonyms
None
SMILES
ClC1=CC=C(C=C1Cl)C2(O)C=3C=CC=CC3CCC2
Tpsa
20.23
Logp
4.5656
H Acceptors
1
H Donors
1
Rotatable Bonds
1
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₆H₁₄Cl₂O
Molecular Weight: 293.19
Synonyms: None
SMILES: ClC1=CC=C(C=C1Cl)C2(O)C=3C=CC=CC3CCC2
Tpsa: 20.23
Logp: 4.5656
H Acceptors: 1
H Donors: 1
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:
C₁₆H₁₄Cl₂O
Molecular Weight:
293.19
Synonyms:
None
SMILES:
ClC1=CC=C(C=C1Cl)C2(O)C=3C=CC=CC3CCC2
Tpsa:
20.23
Logp:
4.5656
H Acceptors:
1
H Donors:
1
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: C₅₀H₅₀O₂₀
Molecular Weight: 970.92
Synonyms: None
SMILES: O=C1[C@@]2([C@@H](C=3C([C@@H](O[C@@H]4O[C@]5([C@]([C@H](O)[C@H]4O)(O[C@H](C)OC5)[H])[H])[C@]2(CO1)[H])=CC6=C(C3)OCO6)C7=CC(OC)=C(O[C@H]8C=9C([C@H]([C@@]%10([C@@]8(COC%10=O)[H])[H])C%11=CC(OC)=C(O)C(OC)=C%11)=CC%12=C(C9)OCO%12)C(OC)=C7)[H]
Tpsa: 233.28
Logp: 4.1393
H Acceptors: 20
H Donors: 3
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₀H₅₀O₂₀
Molecular Weight:
970.92
Synonyms:
None
SMILES:
O=C1[C@@]2([C@@H](C=3C([C@@H](O[C@@H]4O[C@]5([C@]([C@H](O)[C@H]4O)(O[C@H](C)OC5)[H])[H])[C@]2(CO1)[H])=CC6=C(C3)OCO6)C7=CC(OC)=C(O[C@H]8C=9C([C@H]([C@@]%10([C@@]8(COC%10=O)[H])[H])C%11=CC(OC)=C(O)C(OC)=C%11)=CC%12=C(C9)OCO%12)C(OC)=C7)[H]
Tpsa:
233.28
Logp:
4.1393
H Acceptors:
20
H Donors:
3
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₀O₁₁
Molecular Weight: 496.42
Synonyms: None
SMILES: O=C(O)C=1OC2=CC=CC(OCC(O)COC=3C=CC=C4OC(=CC(=O)C43)C(=O)OCC)=C2C(=O)C1
Tpsa: 162.71
Logp: 2.593
H Acceptors: 10
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₂₀O₁₁
Molecular Weight:
496.42
Synonyms:
None
SMILES:
O=C(O)C=1OC2=CC=CC(OCC(O)COC=3C=CC=C4OC(=CC(=O)C43)C(=O)OCC)=C2C(=O)C1
Tpsa:
162.71
Logp:
2.593
H Acceptors:
10
H Donors:
2
Rotatable Bonds:
9
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₂₄ClNO₃
Molecular Weight: 457.95
Synonyms: None
SMILES: C(=C/C1=CC([C@@H](CCC2=C(C(OC)=O)C=CC=C2)O)=CC=C1)\C3=NC4=C(C=C3)C=CC(Cl)=C4
Tpsa: 59.42
Logp: 6.5114
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 7
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₂₄ClNO₃
Molecular Weight:
457.95
Synonyms:
None
SMILES:
C(=C/C1=CC([C@@H](CCC2=C(C(OC)=O)C=CC=C2)O)=CC=C1)\C3=NC4=C(C=C3)C=CC(Cl)=C4
Tpsa:
59.42
Logp:
6.5114
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
7