CS-0569692
(3AS,4R,5aR,9aR,9bS)-2,2,8,8-tetramethylhexahydro-[1,3]dioxolo[4',5':4,5]pyrano[3,2-d][1,3]dioxin-4-yl acetate
Manufacturer: ChemScene
CAS Number: 68791-10-6
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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
C₁₄H₂₂O₇
Molecular Weight
302.32
Synonyms
None
SMILES
CC1(O[C@H]([C@@H](CO1)O2)[C@H](O3)[C@H](OC3(C)C)[C@H]2OC(C)=O)C
Tpsa
72.45
Logp
0.946
H Acceptors
7
H Donors
0
Rotatable Bonds
1
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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: C₁₄H₂₂O₇
Molecular Weight: 302.32
Synonyms: None
SMILES: CC1(O[C@H]([C@@H](CO1)O2)[C@H](O3)[C@H](OC3(C)C)[C@H]2OC(C)=O)C
Tpsa: 72.45
Logp: 0.946
H Acceptors: 7
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:
C₁₄H₂₂O₇
Molecular Weight:
302.32
Synonyms:
None
SMILES:
CC1(O[C@H]([C@@H](CO1)O2)[C@H](O3)[C@H](OC3(C)C)[C@H]2OC(C)=O)C
Tpsa:
72.45
Logp:
0.946
H Acceptors:
7
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: C₂₁H₂₄O₆
Molecular Weight: 372.41
Synonyms: None
SMILES: O[C@@H]([C@@H]([C@@H](CO1)O2)OC1C3=CC=CC=C3)[C@H](OCC4=CC=CC=C4)[C@H]2OC
Tpsa: 66.38
Logp: 2.4182
H Acceptors: 6
H Donors: 1
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:
C₂₁H₂₄O₆
Molecular Weight:
372.41
Synonyms:
None
SMILES:
O[C@@H]([C@@H]([C@@H](CO1)O2)OC1C3=CC=CC=C3)[C@H](OCC4=CC=CC=C4)[C@H]2OC
Tpsa:
66.38
Logp:
2.4182
H Acceptors:
6
H Donors:
1
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: C₇H₁₂O₇
Molecular Weight: 208.17
Synonyms: Varenicline Carbamoyl beta
SMILES: OC1[C@@H]([C@H]([C@@H]([C@@H](C(OC)=O)O1)O)O)O
Tpsa: 116.45
Logp: -3.0407
H Acceptors: 7
H Donors: 4
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:
C₇H₁₂O₇
Molecular Weight:
208.17
Synonyms:
Varenicline Carbamoyl beta
SMILES:
OC1[C@@H]([C@H]([C@@H]([C@@H](C(OC)=O)O1)O)O)O
Tpsa:
116.45
Logp:
-3.0407
H Acceptors:
7
H Donors:
4
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: C₁₉H₂₀O₅S
Molecular Weight: 360.42
Synonyms: Phenyl 4,6-O-benzylidene-β-D-thiomannopyranoside
SMILES: O[C@@H]([C@H]([C@@H]([C@@H](CO1)O2)OC1C3=CC=CC=C3)O)[C@@H]2SC4=CC=CC=C4
Tpsa: 68.15
Logp: 2.3396
H Acceptors: 6
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:
C₁₉H₂₀O₅S
Molecular Weight:
360.42
Synonyms:
Phenyl 4,6-O-benzylidene-β-D-thiomannopyranoside
SMILES:
O[C@@H]([C@H]([C@@H]([C@@H](CO1)O2)OC1C3=CC=CC=C3)O)[C@@H]2SC4=CC=CC=C4
Tpsa:
68.15
Logp:
2.3396
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3