CS-0914415
(R)-quinuclidin-3-yl benzoyl(phenethyl)carbamate
Manufacturer: ChemScene
CAS Number: 1798817-91-0
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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
C₂₃H₂₆N₂O₃
Molecular Weight
378.46
Synonyms
None
SMILES
O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa
49.85
Logp
3.9499
H Acceptors
4
H Donors
0
Rotatable Bonds
5
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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: C₂₃H₂₆N₂O₃
Molecular Weight: 378.46
Synonyms: None
SMILES: O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa: 49.85
Logp: 3.9499
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:
C₂₃H₂₆N₂O₃
Molecular Weight:
378.46
Synonyms:
None
SMILES:
O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa:
49.85
Logp:
3.9499
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: C₁₈H₁₉NO₄S₂
Molecular Weight: 377.48
Synonyms: None
SMILES: CN1[C@@]2([C@]3([C@](O3)([C@]1(C[C@H](OC(C(O)(C4=CC=CS4)C5=CC=CS5)=O)C2)[H])[H])[H])[H]
Tpsa: 62.3
Logp: 2.2011
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₉NO₄S₂
Molecular Weight:
377.48
Synonyms:
None
SMILES:
CN1[C@@]2([C@]3([C@](O3)([C@]1(C[C@H](OC(C(O)(C4=CC=CS4)C5=CC=CS5)=O)C2)[H])[H])[H])[H]
Tpsa:
62.3
Logp:
2.2011
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₂BrNO₄S₂
Molecular Weight: 472.42
Synonyms: None
SMILES: C(C(O[C@H]1C[C@]2([C@]3([C@@]([C@@](C1)([N+]2(C)C)[H])(O3)[H])[H])[H])=O)(O)(C=4C=CSC4)C5=CC=CS5.[Br-]
Tpsa: 59.06
Logp: -0.6503
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₂BrNO₄S₂
Molecular Weight:
472.42
Synonyms:
None
SMILES:
C(C(O[C@H]1C[C@]2([C@]3([C@@]([C@@](C1)([N+]2(C)C)[H])(O3)[H])[H])[H])=O)(O)(C=4C=CSC4)C5=CC=CS5.[Br-]
Tpsa:
59.06
Logp:
-0.6503
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₁NO₂
Molecular Weight: 271.35
Synonyms: None
SMILES: O(C(C(=C)C1=CC=CC=C1)=O)[C@H]2C[C@]3(N(C)[C@@](C2)(CC3)[H])[H]
Tpsa: 29.54
Logp: 2.8682
H Acceptors: 3
H Donors: 0
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:
C₁₇H₂₁NO₂
Molecular Weight:
271.35
Synonyms:
None
SMILES:
O(C(C(=C)C1=CC=CC=C1)=O)[C@H]2C[C@]3(N(C)[C@@](C2)(CC3)[H])[H]
Tpsa:
29.54
Logp:
2.8682
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3