CS-1013859
Ethinylestradiol Delta-8(9) Impurity
Manufacturer: ChemScene
CAS Number: 100019-04-3
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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
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
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 100019-04-3 | delta-8(9)-Ethynylestradiol | 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: 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
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₄BrN₇O₂
Molecular Weight: 534.41
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(C#N)=CC3C)C)C(Br)=C(N2)N(C)CCCC(=O)N
Tpsa: 140.95
Logp: 4.8369
H Acceptors: 8
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:
C₂₅H₂₄BrN₇O₂
Molecular Weight:
534.41
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)NC=2N=C(OC=3C(=CC(C#N)=CC3C)C)C(Br)=C(N2)N(C)CCCC(=O)N
Tpsa:
140.95
Logp:
4.8369
H Acceptors:
8
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: C₁₈H₂₉NO₂
Molecular Weight: 291.43
Synonyms: None
SMILES: O=C(O)C(N)CCC1=CC=C(C=C1)CCCCCCCC
Tpsa: 63.32
Logp: 3.9341
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₉NO₂
Molecular Weight:
291.43
Synonyms:
None
SMILES:
O=C(O)C(N)CCC1=CC=C(C=C1)CCCCCCCC
Tpsa:
63.32
Logp:
3.9341
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
11