CS-0533517
(8R,9S,13S,14S,17R)-13-Ethyl-17-ethynyl-3-methoxy-4,6,7,8,9,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol Levonorgestrel Impurity
Manufacturer: ChemScene
CAS Number: 14507-51-8
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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
C₂₂H₃₀O₂
Molecular Weight
326.47
Synonyms
(8R,9S,13S,14S,17R)-13-ethyl-17-ethynyl-3-methoxy-4,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
SMILES
CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@](C4=C(CC(OC)=CC4)CC3)([H])CC1
Tpsa
29.46
Logp
4.5978
H Acceptors
2
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/health-hazard.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
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: C₂₂H₃₀O₂
Molecular Weight: 326.47
Synonyms: (8R,9S,13S,14S,17R)-13-ethyl-17-ethynyl-3-methoxy-4,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
SMILES: CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@](C4=C(CC(OC)=CC4)CC3)([H])CC1
Tpsa: 29.46
Logp: 4.5978
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:
C₂₂H₃₀O₂
Molecular Weight:
326.47
Synonyms:
(8R,9S,13S,14S,17R)-13-ethyl-17-ethynyl-3-methoxy-4,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ol
SMILES:
CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@](C4=C(CC(OC)=CC4)CC3)([H])CC1
Tpsa:
29.46
Logp:
4.5978
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: C₂₂H₂₈O₂
Molecular Weight: 324.46
Synonyms: (8R,9s,13s,14s,17r)-13-ethyl-17-ethynyl-3-methoxy-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-ol
SMILES: CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@](C4=CC=C(OC)C=C4CC3)([H])CC1
Tpsa: 29.46
Logp: 4.3057
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:
C₂₂H₂₈O₂
Molecular Weight:
324.46
Synonyms:
(8R,9s,13s,14s,17r)-13-ethyl-17-ethynyl-3-methoxy-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-ol
SMILES:
CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@](C4=CC=C(OC)C=C4CC3)([H])CC1
Tpsa:
29.46
Logp:
4.3057
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: C₁₉H₂₁ClN₂O₂
Molecular Weight: 344.84
Synonyms: Cinnarizine Impurity 43
SMILES: OC(CN(CC1)CCN1[C@H](C2=CC=CC=C2)C3=CC=C(C=C3)Cl)=O
Tpsa: 43.78
Logp: 3.1316
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₁ClN₂O₂
Molecular Weight:
344.84
Synonyms:
Cinnarizine Impurity 43
SMILES:
OC(CN(CC1)CCN1[C@H](C2=CC=CC=C2)C3=CC=C(C=C3)Cl)=O
Tpsa:
43.78
Logp:
3.1316
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₇ClFNO₂
Molecular Weight: 403.92
Synonyms: 4-(4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl)-1-(3-ethyl-4-fluorophenyl)butan-1-one
SMILES: O=C(CCCN1CCC(C2=CC=C(C=C2)Cl)(CC1)O)C3=CC=C(C(CC)=C3)F
Tpsa: 40.54
Logp: 4.988
H Acceptors: 3
H Donors: 1
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:
C₂₃H₂₇ClFNO₂
Molecular Weight:
403.92
Synonyms:
4-(4-(4-Chlorophenyl)-4-hydroxypiperidin-1-yl)-1-(3-ethyl-4-fluorophenyl)butan-1-one
SMILES:
O=C(CCCN1CCC(C2=CC=C(C=C2)Cl)(CC1)O)C3=CC=C(C(CC)=C3)F
Tpsa:
40.54
Logp:
4.988
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
7