CS-0531640
(4aS,4bR,10bS,12aS)-8-Hydroxy-12a-methyl-3,4,4a,4b,5,6,10b,11,12,12a-decahydro-1H-naphtho[2,1-f]isochromen-1-one Estriol Impurity
Manufacturer: ChemScene
CAS Number: 15370-49-7
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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
C₁₈H₂₂O₃
Molecular Weight
286.37
Synonyms
Estriol Impurity 9 (Estriol EP Impurity I)
SMILES
C[C@@]12[C@](CCOC2=O)([H])[C@@]3([H])[C@@](CC1)([H])C4=CC=C(O)C=C4CC3
Tpsa
46.53
Logp
3.4014
H Acceptors
3
H Donors
1
Rotatable Bonds
0
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 15370-49-7 | 3-Hydroxy-17-oxa-17a-homoestra-1,3,5(10)-trien-17a-one | A2B Chem | -- |
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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: C₁₈H₂₂O₃
Molecular Weight: 286.37
Synonyms: Estriol Impurity 9 (Estriol EP Impurity I)
SMILES: C[C@@]12[C@](CCOC2=O)([H])[C@@]3([H])[C@@](CC1)([H])C4=CC=C(O)C=C4CC3
Tpsa: 46.53
Logp: 3.4014
H Acceptors: 3
H Donors: 1
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:
C₁₈H₂₂O₃
Molecular Weight:
286.37
Synonyms:
Estriol Impurity 9 (Estriol EP Impurity I)
SMILES:
C[C@@]12[C@](CCOC2=O)([H])[C@@]3([H])[C@@](CC1)([H])C4=CC=C(O)C=C4CC3
Tpsa:
46.53
Logp:
3.4014
H Acceptors:
3
H Donors:
1
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: C₈H₈F₃NO₂S
Molecular Weight: 239.21
Synonyms: None
SMILES: O=S(C1=CC(C)=CC=C1N)(C(F)(F)F)=O
Tpsa: 60.16
Logp: 1.87072
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈F₃NO₂S
Molecular Weight:
239.21
Synonyms:
None
SMILES:
O=S(C1=CC(C)=CC=C1N)(C(F)(F)F)=O
Tpsa:
60.16
Logp:
1.87072
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₂ClN₃O₄S
Molecular Weight: 353.78
Synonyms: None
SMILES: O=C(C(N1)=C(O)C2=C(C=CC=C2)S1(=O)=O)NC3=NC=CC=C3.Cl
Tpsa: 108.39
Logp: 1.6606
H Acceptors: 5
H Donors: 3
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:
C₁₄H₁₂ClN₃O₄S
Molecular Weight:
353.78
Synonyms:
None
SMILES:
O=C(C(N1)=C(O)C2=C(C=CC=C2)S1(=O)=O)NC3=NC=CC=C3.Cl
Tpsa:
108.39
Logp:
1.6606
H Acceptors:
5
H Donors:
3
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: C₁₅H₁₉NO₄
Molecular Weight: 277.32
Synonyms: N-(3-Acetyl-4-(oxiran-2-ylmethoxy)phenyl)butanamide
SMILES: O=C(CCC)NC1=CC=C(C(C(C)=O)=C1)OCC2OC2
Tpsa: 67.93
Logp: 2.4054
H Acceptors: 4
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:
C₁₅H₁₉NO₄
Molecular Weight:
277.32
Synonyms:
N-(3-Acetyl-4-(oxiran-2-ylmethoxy)phenyl)butanamide
SMILES:
O=C(CCC)NC1=CC=C(C(C(C)=O)=C1)OCC2OC2
Tpsa:
67.93
Logp:
2.4054
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
7