CS-1004136
Spironolactone Impurity 13
Manufacturer: ChemScene
CAS Number: 53866-23-2
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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
C₂₂H₃₂O₂
Molecular Weight
328.49
Synonyms
None
SMILES
C[C@@]12[C@]3(CO3)CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(=CC4)C=C(OCC)CC5)[H])[H])[H]
Tpsa
21.76
Logp
5.2485
H Acceptors
2
H Donors
0
Rotatable Bonds
2
Related Products
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: C₂₂H₃₂O₂
Molecular Weight: 328.49
Synonyms: None
SMILES: C[C@@]12[C@]3(CO3)CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(=CC4)C=C(OCC)CC5)[H])[H])[H]
Tpsa: 21.76
Logp: 5.2485
H Acceptors: 2
H Donors: 0
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:
C₂₂H₃₂O₂
Molecular Weight:
328.49
Synonyms:
None
SMILES:
C[C@@]12[C@]3(CO3)CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(=CC4)C=C(OCC)CC5)[H])[H])[H]
Tpsa:
21.76
Logp:
5.2485
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₆O₂
Molecular Weight: 298.42
Synonyms: None
SMILES: C[C@@]12[C@]3(CO3)CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(C=C4)=CC(=O)CC5)[H])[H])[H]
Tpsa: 29.6
Logp: 4.0633
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₆O₂
Molecular Weight:
298.42
Synonyms:
None
SMILES:
C[C@@]12[C@]3(CO3)CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(C=C4)=CC(=O)CC5)[H])[H])[H]
Tpsa:
29.6
Logp:
4.0633
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃NO₃
Molecular Weight: 207.23
Synonyms: None
SMILES: O=CN(C1=CC=C(C=C1)C(=O)OCC)C
Tpsa: 46.61
Logp: 1.4559
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:
C₁₁H₁₃NO₃
Molecular Weight:
207.23
Synonyms:
None
SMILES:
O=CN(C1=CC=C(C=C1)C(=O)OCC)C
Tpsa:
46.61
Logp:
1.4559
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₇FO₃S
Molecular Weight: 356.41
Synonyms: None
SMILES: C(=C\1/C=2C(C(CC(O)=O)=C1C)=CC(F)=CC2)\C3=CC=C(S(C)=O)C=C3
Tpsa: 54.37
Logp: 4.3655
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₁₇FO₃S
Molecular Weight:
356.41
Synonyms:
None
SMILES:
C(=C\1/C=2C(C(CC(O)=O)=C1C)=CC(F)=CC2)\C3=CC=C(S(C)=O)C=C3
Tpsa:
54.37
Logp:
4.3655
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4