CS-1013857
Estradiol Divalerate 6-Keto Impurity
Manufacturer: ChemScene
CAS Number: 1350468-78-8
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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
C₂₈H₃₈O₅
Molecular Weight
454.60
Synonyms
None
SMILES
C[C@@]12[C@]([C@]3([C@@](C=4C(C(=O)C3)=CC(OC(CCCC)=O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC(CCCC)=O)[H]
Tpsa
69.67
Logp
6.3805
H Acceptors
5
H Donors
0
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1350468-78-8 | 6-Keto estradiol-3,17b-divalerate | A2B Chem | -- |
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: C₂₈H₃₈O₅
Molecular Weight: 454.60
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3([C@@](C=4C(C(=O)C3)=CC(OC(CCCC)=O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC(CCCC)=O)[H]
Tpsa: 69.67
Logp: 6.3805
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₈O₅
Molecular Weight:
454.60
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3([C@@](C=4C(C(=O)C3)=CC(OC(CCCC)=O)=CC4)(CC1)[H])[H])(CC[C@@H]2OC(CCCC)=O)[H]
Tpsa:
69.67
Logp:
6.3805
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀Cl₂O₄
Molecular Weight: 289.11
Synonyms: None
SMILES: O=C(O)COC1=CC=C(C(=O)C(=C)C)C(Cl)=C1Cl
Tpsa: 63.6
Logp: 3.2156
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:
C₁₂H₁₀Cl₂O₄
Molecular Weight:
289.11
Synonyms:
None
SMILES:
O=C(O)COC1=CC=C(C(=O)C(=C)C)C(Cl)=C1Cl
Tpsa:
63.6
Logp:
3.2156
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: C₂₀H₂₂O₂
Molecular Weight: 294.39
Synonyms: None
SMILES: C[C@@]12[C@](C3=C(CC1)C=4C(CC3)=CC(O)=CC4)(CC[C@]2(C#C)O)[H]
Tpsa: 40.46
Logp: 3.6664
H Acceptors: 2
H Donors: 2
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:
C₂₀H₂₂O₂
Molecular Weight:
294.39
Synonyms:
None
SMILES:
C[C@@]12[C@](C3=C(CC1)C=4C(CC3)=CC(O)=CC4)(CC[C@]2(C#C)O)[H]
Tpsa:
40.46
Logp:
3.6664
H Acceptors:
2
H Donors:
2
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: C₂₀H₁₄BrN₅O
Molecular Weight: 420.26
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)NC2=NC=C(Br)C(=N2)OC=3C(=CC(C#N)=CC3C)C
Tpsa: 94.62
Logp: 5.1352
H Acceptors: 6
H Donors: 1
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:
C₂₀H₁₄BrN₅O
Molecular Weight:
420.26
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)NC2=NC=C(Br)C(=N2)OC=3C(=CC(C#N)=CC3C)C
Tpsa:
94.62
Logp:
5.1352
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4