CS-0655064
(1R,2R,3R,Z)-5-((E)-2-((1R,3aS,7aR)-1-((R)-6-Hydroxy-6-methylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-3-(3-hydroxypropoxy)-4-methylenecyclohexane-1,2-diol
Manufacturer: ChemScene
CAS Number: 1809782-41-9
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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
C₃₀H₅₀O₅
Molecular Weight
490.72
Synonyms
None
SMILES
C[C@@]12[C@](CC[C@]2([H])[C@H](C)CCCC(C)(O)C)([H])/C(CCC1)=C/C=C3C([C@H]([C@@H]([C@@H](C\3)O)O)OCCCO)=C
Tpsa
90.15
Logp
5.0822
H Acceptors
5
H Donors
4
Rotatable Bonds
10
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: C₃₀H₅₀O₅
Molecular Weight: 490.72
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@]2([H])[C@H](C)CCCC(C)(O)C)([H])/C(CCC1)=C/C=C3C([C@H]([C@@H]([C@@H](C\3)O)O)OCCCO)=C
Tpsa: 90.15
Logp: 5.0822
H Acceptors: 5
H Donors: 4
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₅₀O₅
Molecular Weight:
490.72
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@]2([H])[C@H](C)CCCC(C)(O)C)([H])/C(CCC1)=C/C=C3C([C@H]([C@@H]([C@@H](C\3)O)O)OCCCO)=C
Tpsa:
90.15
Logp:
5.0822
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄F₂O₃
Molecular Weight: 244.23
Synonyms: None
SMILES: FC1=C([C@]2(CO)OC[C@@]([H])(CO)C2)C=CC(F)=C1
Tpsa: 49.69
Logp: 1.1812
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₄F₂O₃
Molecular Weight:
244.23
Synonyms:
None
SMILES:
FC1=C([C@]2(CO)OC[C@@]([H])(CO)C2)C=CC(F)=C1
Tpsa:
49.69
Logp:
1.1812
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Store at room temperature, keep dry and cool
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: None
Molecular Weight: None
Synonyms: None
SMILES: C1=CNC=C1.[n]
Tpsa: 46.29
Logp: 0.5341
H Acceptors: 0
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Store at room temperature, keep dry and cool
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
None
Molecular Weight:
None
Synonyms:
None
SMILES:
C1=CNC=C1.[n]
Tpsa:
46.29
Logp:
0.5341
H Acceptors:
0
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: C₁₉H₂₄O₄S
Molecular Weight: 348.46
Synonyms: None
SMILES: C[C@H](OCC1=CC=CC=C1)[C@@H](OS(C2=CC=C(C)C=C2)(=O)=O)CC
Tpsa: 52.6
Logp: 4.08422
H Acceptors: 4
H Donors: 0
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:
C₁₉H₂₄O₄S
Molecular Weight:
348.46
Synonyms:
None
SMILES:
C[C@H](OCC1=CC=CC=C1)[C@@H](OS(C2=CC=C(C)C=C2)(=O)=O)CC
Tpsa:
52.6
Logp:
4.08422
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
8