CS-0653702
(1R,3aR,7aR)-Octahydro-7a-methyl-1-[(1S)-1-methyl-2-[[(4-methylphenyl)sulfonyl]oxy]ethyl]-4H-inden-4-one
Manufacturer: ChemScene
CAS Number: 342645-83-4
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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
C₂₀H₂₈O₄S
Molecular Weight
364.50
Synonyms
None
SMILES
O=C1[C@]2([H])CC[C@H]([C@H](C)COS(=O)(C3=CC=C(C)C=C3)=O)[C@@]2(C)CCC1
Tpsa
60.44
Logp
4.12192
H Acceptors
4
H Donors
0
Rotatable Bonds
5
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: C₂₀H₂₈O₄S
Molecular Weight: 364.50
Synonyms: None
SMILES: O=C1[C@]2([H])CC[C@H]([C@H](C)COS(=O)(C3=CC=C(C)C=C3)=O)[C@@]2(C)CCC1
Tpsa: 60.44
Logp: 4.12192
H Acceptors: 4
H Donors: 0
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:
C₂₀H₂₈O₄S
Molecular Weight:
364.50
Synonyms:
None
SMILES:
O=C1[C@]2([H])CC[C@H]([C@H](C)COS(=O)(C3=CC=C(C)C=C3)=O)[C@@]2(C)CCC1
Tpsa:
60.44
Logp:
4.12192
H Acceptors:
4
H Donors:
0
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: C₂₅H₅₂O₂Si₂
Molecular Weight: 440.85
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@]2([H])[C@H](C)CO[Si](C)(C)C(C)(C)C)([H])[C@H](CCC1)O[Si](C)(C)C(C)(C)C
Tpsa: 18.46
Logp: 8.2511
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₅₂O₂Si₂
Molecular Weight:
440.85
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@]2([H])[C@H](C)CO[Si](C)(C)C(C)(C)C)([H])[C@H](CCC1)O[Si](C)(C)C(C)(C)C
Tpsa:
18.46
Logp:
8.2511
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₃₉O₂PSi
Molecular Weight: 454.66
Synonyms: None
SMILES: C=CCC[C@H](O[Si](C)(C)C(C)(C)C)C/C=C/CP(C1=CC=CC=C1)(C2=CC=CC=C2)=O
Tpsa: 26.3
Logp: 7.3034
H Acceptors: 2
H Donors: 0
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:
C₂₇H₃₉O₂PSi
Molecular Weight:
454.66
Synonyms:
None
SMILES:
C=CCC[C@H](O[Si](C)(C)C(C)(C)C)C/C=C/CP(C1=CC=CC=C1)(C2=CC=CC=C2)=O
Tpsa:
26.3
Logp:
7.3034
H Acceptors:
2
H Donors:
0
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: C₁₂H₁₁N
Molecular Weight: 169.22
Synonyms: None
SMILES: CC(C=C1)=CC=C1C2=NC=CC=C2
Tpsa: 12.89
Logp: 3.05702
H Acceptors: 1
H Donors: 0
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:
C₁₂H₁₁N
Molecular Weight:
169.22
Synonyms:
None
SMILES:
CC(C=C1)=CC=C1C2=NC=CC=C2
Tpsa:
12.89
Logp:
3.05702
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1