CS-0648562
(2R,3R,4S,5R,6R)-2-((Benzoyloxy)methyl)-6-(((2R,3R,4S,5R)-4,5-bis(benzoyloxy)-2-((benzoyloxy)methyl)-6-bromotetrahydro-2H-pyran-3-yl)oxy)tetrahydro-2H-pyran-3,4,5-triyl tribenzoate
Manufacturer: ChemScene
CAS Number: 855662-14-5
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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
C₆₁H₄₉BrO₁₇
Molecular Weight
1133.94
Synonyms
None
SMILES
O=C(C1=CC=CC=C1)OC[C@H]2OC([C@@H]([C@H]([C@@H]2O[C@H]3O[C@@H]([C@H]([C@@H]([C@H]3OC(C4=CC=CC=C4)=O)OC(C5=CC=CC=C5)=O)OC(C6=CC=CC=C6)=O)COC(C7=CC=CC=C7)=O)OC(C8=CC=CC=C8)=O)OC(C9=CC=CC=C9)=O)Br
Tpsa
211.79
Logp
9.0583
H Acceptors
17
H Donors
0
Rotatable Bonds
18
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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-P330-P362+P364-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: C₆₁H₄₉BrO₁₇
Molecular Weight: 1133.94
Synonyms: None
SMILES: O=C(C1=CC=CC=C1)OC[C@H]2OC([C@@H]([C@H]([C@@H]2O[C@H]3O[C@@H]([C@H]([C@@H]([C@H]3OC(C4=CC=CC=C4)=O)OC(C5=CC=CC=C5)=O)OC(C6=CC=CC=C6)=O)COC(C7=CC=CC=C7)=O)OC(C8=CC=CC=C8)=O)OC(C9=CC=CC=C9)=O)Br
Tpsa: 211.79
Logp: 9.0583
H Acceptors: 17
H Donors: 0
Rotatable Bonds: 18
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆₁H₄₉BrO₁₇
Molecular Weight:
1133.94
Synonyms:
None
SMILES:
O=C(C1=CC=CC=C1)OC[C@H]2OC([C@@H]([C@H]([C@@H]2O[C@H]3O[C@@H]([C@H]([C@@H]([C@H]3OC(C4=CC=CC=C4)=O)OC(C5=CC=CC=C5)=O)OC(C6=CC=CC=C6)=O)COC(C7=CC=CC=C7)=O)OC(C8=CC=CC=C8)=O)OC(C9=CC=CC=C9)=O)Br
Tpsa:
211.79
Logp:
9.0583
H Acceptors:
17
H Donors:
0
Rotatable Bonds:
18
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₂Br₂F₄O₂
Molecular Weight: 365.90
Synonyms: None
SMILES: O=C(C1=C(C=C(C(F)(F)F)C(Br)=C1Br)F)O
Tpsa: 37.3
Logp: 4.0677
H Acceptors: 1
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:
C₈H₂Br₂F₄O₂
Molecular Weight:
365.90
Synonyms:
None
SMILES:
O=C(C1=C(C=C(C(F)(F)F)C(Br)=C1Br)F)O
Tpsa:
37.3
Logp:
4.0677
H Acceptors:
1
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: C₁₅H₁₃N₃O
Molecular Weight: 251.28
Synonyms: None
SMILES: O=C(C)C1=CC=C(N2C(C)=NC3=C2C=CN=C3)C=C1
Tpsa: 47.78
Logp: 2.93152
H Acceptors: 4
H Donors: 0
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:
C₁₅H₁₃N₃O
Molecular Weight:
251.28
Synonyms:
None
SMILES:
O=C(C)C1=CC=C(N2C(C)=NC3=C2C=CN=C3)C=C1
Tpsa:
47.78
Logp:
2.93152
H Acceptors:
4
H Donors:
0
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: C₁₀H₁₇F₂NO₄
Molecular Weight: 253.24
Synonyms: None
SMILES: FCC(CF)[C@@H](C(O)=O)NC(OC(C)(C)C)=O
Tpsa: 75.63
Logp: 1.5195
H Acceptors: 3
H Donors: 2
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:
C₁₀H₁₇F₂NO₄
Molecular Weight:
253.24
Synonyms:
None
SMILES:
FCC(CF)[C@@H](C(O)=O)NC(OC(C)(C)C)=O
Tpsa:
75.63
Logp:
1.5195
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
5