CS-0531425
(1R,2R)-1-(3,4-Dimethoxybenzyl)-6,7-dimethoxy-2-(3-methoxy-3-oxopropyl)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium iodide Atracurium Impurity
Manufacturer: ChemScene
CAS Number: 1075726-91-8
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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
C₂₅H₃₄INO₆
Molecular Weight
571.45
Synonyms
None
SMILES
COC(C=C(CC[N@+]1(C)CCC(OC)=O)C([C@H]1CC2=CC(OC)=C(C=C2)OC)=C3)=C3OC.[I-]
Tpsa
63.22
Logp
0.5746
H Acceptors
6
H Donors
0
Rotatable Bonds
9
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1075726-91-8 | (1R,2R)-1-(3,4-Dimethoxybenzyl)-6,7-dimethoxy-2-(3-methoxy-3-oxopropyl)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium | A2B Chem | -- |
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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: C₂₅H₃₄INO₆
Molecular Weight: 571.45
Synonyms: None
SMILES: COC(C=C(CC[N@+]1(C)CCC(OC)=O)C([C@H]1CC2=CC(OC)=C(C=C2)OC)=C3)=C3OC.[I-]
Tpsa: 63.22
Logp: 0.5746
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₄INO₆
Molecular Weight:
571.45
Synonyms:
None
SMILES:
COC(C=C(CC[N@+]1(C)CCC(OC)=O)C([C@H]1CC2=CC(OC)=C(C=C2)OC)=C3)=C3OC.[I-]
Tpsa:
63.22
Logp:
0.5746
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₄H₃₇FN₂O₅
Molecular Weight: 572.67
Synonyms: 3-O-Methylatorvastatin
SMILES: O=C(C1=C(C(C)C)N(CC[C@@H](O)C[C@@H](OC)CC(O)=O)C(C2=CC=C(C=C2)F)=C1C3=CC=CC=C3)NC4=CC=CC=C4
Tpsa: 100.79
Logp: 6.9677
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₄H₃₇FN₂O₅
Molecular Weight:
572.67
Synonyms:
3-O-Methylatorvastatin
SMILES:
O=C(C1=C(C(C)C)N(CC[C@@H](O)C[C@@H](OC)CC(O)=O)C(C2=CC=C(C=C2)F)=C1C3=CC=CC=C3)NC4=CC=CC=C4
Tpsa:
100.79
Logp:
6.9677
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
13
Purity: 98%
MDL No: MFCD20270623
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₂N₂O₂
Molecular Weight: 250.34
Synonyms: Rivastigmine impurity D
SMILES: CCN(C)C(OC1=CC([C@@H](C)N(C)C)=CC=C1)=O
Tpsa: 32.78
Logp: 2.7597
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD20270623
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₂N₂O₂
Molecular Weight:
250.34
Synonyms:
Rivastigmine impurity D
SMILES:
CCN(C)C(OC1=CC([C@@H](C)N(C)C)=CC=C1)=O
Tpsa:
32.78
Logp:
2.7597
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃ClO₂
Molecular Weight: 224.68
Synonyms: (2-Chlorophenyl) (1-hydroxycyclopentyl) ketone
SMILES: O=C(C1(CCCC1)O)C2=C(Cl)C=CC=C2
Tpsa: 37.3
Logp: 2.8278
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃ClO₂
Molecular Weight:
224.68
Synonyms:
(2-Chlorophenyl) (1-hydroxycyclopentyl) ketone
SMILES:
O=C(C1(CCCC1)O)C2=C(Cl)C=CC=C2
Tpsa:
37.3
Logp:
2.8278
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2