CS-1000554
Paliperidone Impurity 54
Manufacturer: ChemScene
CAS Number: 1160611-32-4
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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
C₁₂H₁₅ClN₂O₂
Molecular Weight
254.71
Synonyms
None
SMILES
O=CC1=C2NC(=C(C(=O)N2CCC1)CCCl)C
Tpsa
49.41
Logp
1.5254
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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: C₁₂H₁₅ClN₂O₂
Molecular Weight: 254.71
Synonyms: None
SMILES: O=CC1=C2NC(=C(C(=O)N2CCC1)CCCl)C
Tpsa: 49.41
Logp: 1.5254
H Acceptors: 3
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:
C₁₂H₁₅ClN₂O₂
Molecular Weight:
254.71
Synonyms:
None
SMILES:
O=CC1=C2NC(=C(C(=O)N2CCC1)CCCl)C
Tpsa:
49.41
Logp:
1.5254
H Acceptors:
3
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: C₂₂H₃₀O₃
Molecular Weight: 342.47
Synonyms: None
SMILES: C(C)[C@@]12[C@]([C@]3([C@]([C@@](C)(O)C1)([C@@]4(C(CC3)=CC(=O)CC4)[H])[H])[H])(CC[C@]2(C#C)O)[H]
Tpsa: 57.53
Logp: 3.2435
H Acceptors: 3
H Donors: 2
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:
C₂₂H₃₀O₃
Molecular Weight:
342.47
Synonyms:
None
SMILES:
C(C)[C@@]12[C@]([C@]3([C@]([C@@](C)(O)C1)([C@@]4(C(CC3)=CC(=O)CC4)[H])[H])[H])(CC[C@]2(C#C)O)[H]
Tpsa:
57.53
Logp:
3.2435
H Acceptors:
3
H Donors:
2
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: C₂₉H₅₀O₃
Molecular Weight: 446.71
Synonyms: None
SMILES: CC1=C2C(O[C@@](CCCC(CCCC(CCCC(CO)C)C)C)(C)CC2)=C(C)C(C)=C1O
Tpsa: 49.69
Logp: 7.81266
H Acceptors: 3
H Donors: 2
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:
C₂₉H₅₀O₃
Molecular Weight:
446.71
Synonyms:
None
SMILES:
CC1=C2C(O[C@@](CCCC(CCCC(CCCC(CO)C)C)C)(C)CC2)=C(C)C(C)=C1O
Tpsa:
49.69
Logp:
7.81266
H Acceptors:
3
H Donors:
2
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: C₂₄H₂₄F₂N₂O₂
Molecular Weight: 410.46
Synonyms: None
SMILES: C(C1=C(OCC2=CC(F)=CC=C2)C=CC(CN[C@@H](C(N)=O)C)=C1)C3=CC(F)=CC=C3
Tpsa: 64.35
Logp: 4.098
H Acceptors: 3
H Donors: 2
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:
C₂₄H₂₄F₂N₂O₂
Molecular Weight:
410.46
Synonyms:
None
SMILES:
C(C1=C(OCC2=CC(F)=CC=C2)C=CC(CN[C@@H](C(N)=O)C)=C1)C3=CC(F)=CC=C3
Tpsa:
64.35
Logp:
4.098
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
9