CS-0531871
1-(1-(4-(2-Fluorophenyl)-4-oxobutyl)-1,2,3,6-tetrahydropyridin-4-yl)-1H-benzo[d]imidazol-2(3H)-one Droperidol Impurity
Manufacturer: ChemScene
CAS Number: 1026015-45-1
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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
C₂₂H₂₂FN₃O₂
Molecular Weight
379.43
Synonyms
Droperidol IMpurity B
SMILES
O=C1NC2=C(N1C3=CCN(CCCC(C4=C(F)C=CC=C4)=O)CC3)C=CC=C2
Tpsa
58.1
Logp
3.6784
H Acceptors
4
H Donors
1
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: C₂₂H₂₂FN₃O₂
Molecular Weight: 379.43
Synonyms: Droperidol IMpurity B
SMILES: O=C1NC2=C(N1C3=CCN(CCCC(C4=C(F)C=CC=C4)=O)CC3)C=CC=C2
Tpsa: 58.1
Logp: 3.6784
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:
C₂₂H₂₂FN₃O₂
Molecular Weight:
379.43
Synonyms:
Droperidol IMpurity B
SMILES:
O=C1NC2=C(N1C3=CCN(CCCC(C4=C(F)C=CC=C4)=O)CC3)C=CC=C2
Tpsa:
58.1
Logp:
3.6784
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅F₂N
Molecular Weight: 153.13
Synonyms: None
SMILES: FC(C1=NC=C(C=C1)C#C)F
Tpsa: 12.89
Logp: 2.0005
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅F₂N
Molecular Weight:
153.13
Synonyms:
None
SMILES:
FC(C1=NC=C(C=C1)C#C)F
Tpsa:
12.89
Logp:
2.0005
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₆N₂O₄
Molecular Weight: 158.11
Synonyms: 5-Methoxypyrimidine-2,4,6-triol
SMILES: O=C1NC(C(C(N1)=O)OC)=O
Tpsa: 84.5
Logp: -1.6326
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₆N₂O₄
Molecular Weight:
158.11
Synonyms:
5-Methoxypyrimidine-2,4,6-triol
SMILES:
O=C1NC(C(C(N1)=O)OC)=O
Tpsa:
84.5
Logp:
-1.6326
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₀N₂O
Molecular Weight: 174.20
Synonyms: None
SMILES: O=C(N)C1=CC=CC(C#CCN)=C1
Tpsa: 69.11
Logp: 0.0957
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₀N₂O
Molecular Weight:
174.20
Synonyms:
None
SMILES:
O=C(N)C1=CC=CC(C#CCN)=C1
Tpsa:
69.11
Logp:
0.0957
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1