CS-1003512
Atomoxetine Impurity 52
Manufacturer: ChemScene
CAS Number: 299435-85-1
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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
C₁₈H₂₃NO
Molecular Weight
269.38
Synonyms
None
SMILES
[C@@H](OC1=C(C)C=CC=C1)(CCN(C)C)C2=CC=CC=C2
Tpsa
12.47
Logp
4.06682
H Acceptors
2
H Donors
0
Rotatable Bonds
6
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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: C₁₈H₂₃NO
Molecular Weight: 269.38
Synonyms: None
SMILES: [C@@H](OC1=C(C)C=CC=C1)(CCN(C)C)C2=CC=CC=C2
Tpsa: 12.47
Logp: 4.06682
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₃NO
Molecular Weight:
269.38
Synonyms:
None
SMILES:
[C@@H](OC1=C(C)C=CC=C1)(CCN(C)C)C2=CC=CC=C2
Tpsa:
12.47
Logp:
4.06682
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₂₉N₃O₅
Molecular Weight: 451.51
Synonyms: None
SMILES: OC(C#CC1=CC=CC(=C1)NC=2N=CN=C3C=C(OCCOC)C(OCCOC)=CC32)(C)C
Tpsa: 94.96
Logp: 3.5462
H Acceptors: 8
H Donors: 2
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:
C₂₅H₂₉N₃O₅
Molecular Weight:
451.51
Synonyms:
None
SMILES:
OC(C#CC1=CC=CC(=C1)NC=2N=CN=C3C=C(OCCOC)C(OCCOC)=CC32)(C)C
Tpsa:
94.96
Logp:
3.5462
H Acceptors:
8
H Donors:
2
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: C₁₅H₁₄BrNO₄
Molecular Weight: 352.18
Synonyms: None
SMILES: O=N(=O)C1=CC(=CC=C1OCC=2C=CC=CC2)C(O)CBr
Tpsa: 72.6
Logp: 3.6021
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₄BrNO₄
Molecular Weight:
352.18
Synonyms:
None
SMILES:
O=N(=O)C1=CC(=CC=C1OCC=2C=CC=CC2)C(O)CBr
Tpsa:
72.6
Logp:
3.6021
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₈I₃NO₅
Molecular Weight: 721.06
Synonyms: None
SMILES: C([C@@H](C(OCC)=O)NC(C)=O)C1=CC(I)=C(OC2=CC(I)=C(O)C=C2)C(I)=C1
Tpsa: 84.86
Logp: 4.6086
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₈I₃NO₅
Molecular Weight:
721.06
Synonyms:
None
SMILES:
C([C@@H](C(OCC)=O)NC(C)=O)C1=CC(I)=C(OC2=CC(I)=C(O)C=C2)C(I)=C1
Tpsa:
84.86
Logp:
4.6086
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
7