CS-0378895
2-(4-Acetylbenzyl)cyclopentanone Loxoprofen Impurity
Manufacturer: ChemScene
CAS Number: 96824-28-1
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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
C₁₄H₁₆O₂
Molecular Weight
216.28
Synonyms
2-[(4-Acetylphenyl)methyl]cyclopentan-1-one
SMILES
O=C(CCC1)C1CC2=CC=C(C(C)=O)C=C2
Tpsa
34.14
Logp
2.8009
H Acceptors
2
H Donors
0
Rotatable Bonds
3
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: C₁₄H₁₆O₂
Molecular Weight: 216.28
Synonyms: 2-[(4-Acetylphenyl)methyl]cyclopentan-1-one
SMILES: O=C(CCC1)C1CC2=CC=C(C(C)=O)C=C2
Tpsa: 34.14
Logp: 2.8009
H Acceptors: 2
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:
C₁₄H₁₆O₂
Molecular Weight:
216.28
Synonyms:
2-[(4-Acetylphenyl)methyl]cyclopentan-1-one
SMILES:
O=C(CCC1)C1CC2=CC=C(C(C)=O)C=C2
Tpsa:
34.14
Logp:
2.8009
H Acceptors:
2
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: C₁₅H₁₄Cl₃N₃O
Molecular Weight: 358.65
Synonyms: None
SMILES: ClC1=C(Cl)C=C(C(NC2=C(C(C)C)N=CC=C2C)=O)C(Cl)=N1
Tpsa: 54.88
Logp: 5.12092
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:
C₁₅H₁₄Cl₃N₃O
Molecular Weight:
358.65
Synonyms:
None
SMILES:
ClC1=C(Cl)C=C(C(NC2=C(C(C)C)N=CC=C2C)=O)C(Cl)=N1
Tpsa:
54.88
Logp:
5.12092
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: C₈H₅Cl₃N₂O₃
Molecular Weight: 283.50
Synonyms: None
SMILES: ClC1=C(Cl)N=C(Cl)C(C(NC(OC)=O)=O)=C1
Tpsa: 68.29
Logp: 2.538
H Acceptors: 4
H Donors: 1
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:
C₈H₅Cl₃N₂O₃
Molecular Weight:
283.50
Synonyms:
None
SMILES:
ClC1=C(Cl)N=C(Cl)C(C(NC(OC)=O)=O)=C1
Tpsa:
68.29
Logp:
2.538
H Acceptors:
4
H Donors:
1
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: C₉H₁₁NO₃
Molecular Weight: 181.19
Synonyms: 1-(prop-2-ynoyl)piperidine-4-carboxylic acid
SMILES: O=C(N1CCC(CC1)C(O)=O)C#C
Tpsa: 57.61
Logp: -0.0572
H Acceptors: 2
H Donors: 1
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:
C₉H₁₁NO₃
Molecular Weight:
181.19
Synonyms:
1-(prop-2-ynoyl)piperidine-4-carboxylic acid
SMILES:
O=C(N1CCC(CC1)C(O)=O)C#C
Tpsa:
57.61
Logp:
-0.0572
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1