CS-1173077
Triethyl(((1R,3aR,4S,7aR)-7a-methyl-1-((R)-6-methyl-6-((triethylsilyl)oxy)heptan-2-yl)octahydro-1H-inden-4-yl)oxy)silane calcitriol impurity
Manufacturer: ChemScene
CAS Number: 235107-98-9
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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
C₃₀H₆₂O₂Si₂
Molecular Weight
510.98
Synonyms
None
SMILES
C[C@@]12[C@](CC[C@@H]2[C@@H](CCCC(C)(O[Si](CC)(CC)CC)C)C)([H])[C@@H](O[Si](CC)(CC)CC)CCC1
Tpsa
18.46
Logp
10.2
H Acceptors
2
H Donors
0
Rotatable Bonds
15
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SAFETY INFORMATION
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: C₃₀H₆₂O₂Si₂
Molecular Weight: 510.98
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@@H]2[C@@H](CCCC(C)(O[Si](CC)(CC)CC)C)C)([H])[C@@H](O[Si](CC)(CC)CC)CCC1
Tpsa: 18.46
Logp: 10.2
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₆₂O₂Si₂
Molecular Weight:
510.98
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@@H]2[C@@H](CCCC(C)(O[Si](CC)(CC)CC)C)C)([H])[C@@H](O[Si](CC)(CC)CC)CCC1
Tpsa:
18.46
Logp:
10.2
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₄₇F₃O₅Si₂
Molecular Weight: 600.86
Synonyms: None
SMILES: O=C(O1)C[C@@H]([C@@H]1C2)[C@@H](/C=C/[C@@H](O[Si](C)(C)C(C)(C)C)COC3=CC(C(F)(F)F)=CC=C3)[C@@H]2O[Si](C)(C)C(C)(C)C
Tpsa: 53.99
Logp: 8.3728
H Acceptors: 5
H Donors: 0
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:
C₃₀H₄₇F₃O₅Si₂
Molecular Weight:
600.86
Synonyms:
None
SMILES:
O=C(O1)C[C@@H]([C@@H]1C2)[C@@H](/C=C/[C@@H](O[Si](C)(C)C(C)(C)C)COC3=CC(C(F)(F)F)=CC=C3)[C@@H]2O[Si](C)(C)C(C)(C)C
Tpsa:
53.99
Logp:
8.3728
H Acceptors:
5
H Donors:
0
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: C₃₁H₂₇F₃O₆
Molecular Weight: 552.54
Synonyms: None
SMILES: O=C(O[C@H]1[C@H](/C=C/[C@@H](O)COC2=CC(C(F)(F)F)=CC=C2)[C@@H](CC(O3)=O)[C@@H]3C1)C4=CC=C(C5=CC=CC=C5)C=C4
Tpsa: 82.06
Logp: 5.8455
H Acceptors: 6
H Donors: 1
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:
C₃₁H₂₇F₃O₆
Molecular Weight:
552.54
Synonyms:
None
SMILES:
O=C(O[C@H]1[C@H](/C=C/[C@@H](O)COC2=CC(C(F)(F)F)=CC=C2)[C@@H](CC(O3)=O)[C@@H]3C1)C4=CC=C(C5=CC=CC=C5)C=C4
Tpsa:
82.06
Logp:
5.8455
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄O₂
Molecular Weight: 238.28
Synonyms: None
SMILES: COC(/C=C/C1=C(C2=CC=CC=C2)C=CC=C1)=O
Tpsa: 26.3
Logp: 3.5398
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄O₂
Molecular Weight:
238.28
Synonyms:
None
SMILES:
COC(/C=C/C1=C(C2=CC=CC=C2)C=CC=C1)=O
Tpsa:
26.3
Logp:
3.5398
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3