CS-1004087
Aripiprazole Impurity 1
Manufacturer: ChemScene
CAS Number: 519138-48-8
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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
C₂₂H₂₇Cl₅N₄
Molecular Weight
524.74
Synonyms
None
SMILES
Cl.ClC1=C(Cl)C(=CC=C1N2CCNCC2)C(C3=CC=C(C(Cl)=C3Cl)N4CCNCC4)C
Tpsa
30.54
Logp
5.693
H Acceptors
4
H Donors
2
Rotatable Bonds
4
Related Products
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: C₂₂H₂₇Cl₅N₄
Molecular Weight: 524.74
Synonyms: None
SMILES: Cl.ClC1=C(Cl)C(=CC=C1N2CCNCC2)C(C3=CC=C(C(Cl)=C3Cl)N4CCNCC4)C
Tpsa: 30.54
Logp: 5.693
H Acceptors: 4
H Donors: 2
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:
C₂₂H₂₇Cl₅N₄
Molecular Weight:
524.74
Synonyms:
None
SMILES:
Cl.ClC1=C(Cl)C(=CC=C1N2CCNCC2)C(C3=CC=C(C(Cl)=C3Cl)N4CCNCC4)C
Tpsa:
30.54
Logp:
5.693
H Acceptors:
4
H Donors:
2
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: C₁₀H₂₀N₂O₂
Molecular Weight: 200.28
Synonyms: None
SMILES: O=C(N)C1CCN(CCCOC)CC1
Tpsa: 55.56
Logp: 0.2202
H Acceptors: 3
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:
C₁₀H₂₀N₂O₂
Molecular Weight:
200.28
Synonyms:
None
SMILES:
O=C(N)C1CCN(CCCOC)CC1
Tpsa:
55.56
Logp:
0.2202
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂F₃NO₄
Molecular Weight: 243.18
Synonyms: None
SMILES: N(C(C(F)(F)F)=O)[C@@H]1[C@H](O)[C@H](C)O[C@@H](O)C1
Tpsa: 78.79
Logp: -0.4784
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂F₃NO₄
Molecular Weight:
243.18
Synonyms:
None
SMILES:
N(C(C(F)(F)F)=O)[C@@H]1[C@H](O)[C@H](C)O[C@@H](O)C1
Tpsa:
78.79
Logp:
-0.4784
H Acceptors:
4
H Donors:
3
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: C₁₅H₁₃NO₂
Molecular Weight: 239.27
Synonyms: None
SMILES: O(C=1C=CC=2NC=3C=CC=CC3C2C1)CC4OC4
Tpsa: 37.55
Logp: 3.0987
H Acceptors: 2
H Donors: 1
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:
C₁₅H₁₃NO₂
Molecular Weight:
239.27
Synonyms:
None
SMILES:
O(C=1C=CC=2NC=3C=CC=CC3C2C1)CC4OC4
Tpsa:
37.55
Logp:
3.0987
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3