CS-0534165
(2'R,8R,9S,10R,13S,14S)-10,13-Dimethyl-1,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-3'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-3,5'(2H,4'H)-dione Spironolactone Impurity
Manufacturer: ChemScene
CAS Number: 976-70-5
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Purity
98%
MDL No
None
Storage
4°C
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₂H₃₀O₃
Molecular Weight
342.47
Synonyms
3-Oxopregn-4-ene-21,17alpha-carbolactone
SMILES
C[C@@]12[C@@]3(OC(CC3)=O)CC[C@@]1([H])[C@@]4([H])[C@]([C@@]5(C(CC4)=CC(CC5)=O)C)([H])CC2
Tpsa
43.37
Logp
4.5941
H Acceptors
3
H Donors
0
Rotatable Bonds
0
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | Spironolactone Related Compound C | Sigma Aldrich | ₹ 1,50,034.50 | |
| | Spironolactone Related Compound C | Supelco | ₹ 66,497.98 | |
 | 976-70-5 | Pregn-4-ene-21-carboxylic acid, 17-hydroxy-3-oxo-, g-lactone, (17a)- | A2B Chem | ₹ 84,875.52 |
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: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₀O₃
Molecular Weight: 342.47
Synonyms: 3-Oxopregn-4-ene-21,17alpha-carbolactone
SMILES: C[C@@]12[C@@]3(OC(CC3)=O)CC[C@@]1([H])[C@@]4([H])[C@]([C@@]5(C(CC4)=CC(CC5)=O)C)([H])CC2
Tpsa: 43.37
Logp: 4.5941
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₃₀O₃
Molecular Weight:
342.47
Synonyms:
3-Oxopregn-4-ene-21,17alpha-carbolactone
SMILES:
C[C@@]12[C@@]3(OC(CC3)=O)CC[C@@]1([H])[C@@]4([H])[C@]([C@@]5(C(CC4)=CC(CC5)=O)C)([H])CC2
Tpsa:
43.37
Logp:
4.5941
H Acceptors:
3
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: C₇H₆BrNO₃
Molecular Weight: 232.03
Synonyms: 5-Bromo-4-methoxypyridine-3-carboxylic acid
SMILES: O=C(C1=C(OC)C(Br)=CN=C1)O
Tpsa: 59.42
Logp: 1.5509
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:
C₇H₆BrNO₃
Molecular Weight:
232.03
Synonyms:
5-Bromo-4-methoxypyridine-3-carboxylic acid
SMILES:
O=C(C1=C(OC)C(Br)=CN=C1)O
Tpsa:
59.42
Logp:
1.5509
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: C₈H₆ClNO₃
Molecular Weight: 199.59
Synonyms: None
SMILES: O=C(C1=CC(Cl)=NC=C1C=O)OC
Tpsa: 56.26
Logp: 1.3341
H Acceptors: 4
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:
C₈H₆ClNO₃
Molecular Weight:
199.59
Synonyms:
None
SMILES:
O=C(C1=CC(Cl)=NC=C1C=O)OC
Tpsa:
56.26
Logp:
1.3341
H Acceptors:
4
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: C₂₂H₃₄O₄
Molecular Weight: 362.50
Synonyms: None
SMILES: C[C@@H]1[C@]23[C@](C(CC3)=O)([H])[C@]([C@@H](C[C@](C)([C@H]1OC(C)=O)C=C)O)([C@@H](CC2)C)C
Tpsa: 63.6
Logp: 3.9128
H Acceptors: 4
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:
C₂₂H₃₄O₄
Molecular Weight:
362.50
Synonyms:
None
SMILES:
C[C@@H]1[C@]23[C@](C(CC3)=O)([H])[C@]([C@@H](C[C@](C)([C@H]1OC(C)=O)C=C)O)([C@@H](CC2)C)C
Tpsa:
63.6
Logp:
3.9128
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2