CS-1172985

(((1R,2R,3R,Z)-2-(3-((tert-Butyldimethylsilyl)oxy)propoxy)-5-(2-((1R,3aS,7aR,Z)-7a-methyl-1-((R)-6-methyl-6-((triethylsilyl)oxy)heptan-2-yl)octahydro-4H-inden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diyl)bis(oxy))bis(tert-butyldimethylsilane) Calcitriol impurity

Manufacturer: ChemScene

CAS Number: None

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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

C₅₄H₁₀₆O₅Si₄

Molecular Weight

947.76

Synonyms

None

SMILES

C[C@]1(CCC/2)[C@](CC[C@@H]1[C@@H](CCCC(C)(C)O[Si](CC)(CC)CC)C)([H])C2=C/C=C3C([C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OCCCO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C\3)=C

Tpsa

46.15

Logp

17.2002

H Acceptors

5

H Donors

0

Rotatable Bonds

21

SAFETY INFORMATION

Pictograms

N/A

Signal Word

N/A

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

N/A

Precautionary Statements

N/A

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Img

ChemScene

CS-1172985

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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:
C₅₄H₁₀₆O₅Si₄

Molecular Weight:
947.76

Synonyms:
None

SMILES:
C[C@]1(CCC/2)[C@](CC[C@@H]1[C@@H](CCCC(C)(C)O[Si](CC)(CC)CC)C)([H])C2=C/C=C3C([C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OCCCO[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)C\3)=C

Tpsa:
46.15

Logp:
17.2002

H Acceptors:
5

H Donors:
0

Rotatable Bonds:
21

Img

ChemScene

CS-1172986

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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:
C₄₅H₈₆O₃Si₃

Molecular Weight:
759.42

Synonyms:
None

SMILES:
C=C1[C@H](O[Si](C)(C(C)(C)C)C)C[C@@H](O[Si](C)(C(C)(C)C)C)C/C1=C/C=C2[C@]3([H])CC[C@H]([C@@H](CCCC(C)(O[Si](C)(C(C)(C)C)C)C)C)[C@@]3(C)CCC/2

Tpsa:
27.69

Logp:
14.7932

H Acceptors:
3

H Donors:
0

Rotatable Bonds:
12

Img

ChemScene

CS-1172987

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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:
C₂₅H₃₄O₃

Molecular Weight:
382.54

Synonyms:
None

SMILES:
C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@@H](C3CC3)O)C)([H])[C@@H](OC(C4=CC=CC=C4)=O)CCC1

Tpsa:
46.53

Logp:
5.3916

H Acceptors:
3

H Donors:
1

Rotatable Bonds:
6

Img

ChemScene

CS-1172988

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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:
C₂₉H₅₈O₅Si₃

Molecular Weight:
571.02

Synonyms:
(5R,6R)-5-((叔丁基二甲基硅烷基)氧基)-6-(3-((叔丁基二甲基硅烷基)氧基)丙氧基)-6-((R)-2,2,3,3-四甲基-3,6-二氢-2H-1,2-氧杂杨林-6-基)己-2-炔-1-醇 (艾迪骨化醇杂质)

SMILES:
OCC#CC[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OCCCO[Si](C)(C)C(C)(C)C)[C@H](O[Si]1(C)C)C=CC1(C)C

Tpsa:
57.15

Logp:
7.5

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
11