CS-1001245
Paliperidone Impurity 77
Manufacturer: ChemScene
CAS Number: 1388035-56-0
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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
C₁₂H₁₃F₂NO
Molecular Weight
225.23
Synonyms
None
SMILES
O=C(C=1C=CC=C(F)C1F)C2CCNCC2
Tpsa
29.1
Logp
2.1471
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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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: C₁₂H₁₃F₂NO
Molecular Weight: 225.23
Synonyms: None
SMILES: O=C(C=1C=CC=C(F)C1F)C2CCNCC2
Tpsa: 29.1
Logp: 2.1471
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃F₂NO
Molecular Weight:
225.23
Synonyms:
None
SMILES:
O=C(C=1C=CC=C(F)C1F)C2CCNCC2
Tpsa:
29.1
Logp:
2.1471
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₈N₂O₂
Molecular Weight: 234.29
Synonyms: None
SMILES: O=C(NC1=CC=C(O)C(=C1)CN2CCCC2)C
Tpsa: 52.57
Logp: 1.9464
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈N₂O₂
Molecular Weight:
234.29
Synonyms:
None
SMILES:
O=C(NC1=CC=C(O)C(=C1)CN2CCCC2)C
Tpsa:
52.57
Logp:
1.9464
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₃₁N₃O₃SSi
Molecular Weight: 421.63
Synonyms: None
SMILES: O=C(C1=CC=CC(=C1C)C)C2=CN=C(N2S(=O)(=O)N(C)C)[Si](C)(C)C(C)(C)C
Tpsa: 72.27
Logp: 3.10094
H Acceptors: 5
H Donors: 0
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:
C₂₀H₃₁N₃O₃SSi
Molecular Weight:
421.63
Synonyms:
None
SMILES:
O=C(C1=CC=CC(=C1C)C)C2=CN=C(N2S(=O)(=O)N(C)C)[Si](C)(C)C(C)(C)C
Tpsa:
72.27
Logp:
3.10094
H Acceptors:
5
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: C₁₄H₁₂ClN
Molecular Weight: 229.70
Synonyms: None
SMILES: C(/N=C/C1=CC=CC=C1)C2=C(Cl)C=CC=C2
Tpsa: 12.36
Logp: 3.9591
H Acceptors: 1
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:
C₁₄H₁₂ClN
Molecular Weight:
229.70
Synonyms:
None
SMILES:
C(/N=C/C1=CC=CC=C1)C2=C(Cl)C=CC=C2
Tpsa:
12.36
Logp:
3.9591
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
3