CS-1004439
Ketoprofen Impurity 55
Manufacturer: ChemScene
CAS Number: 64379-72-2
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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
C₁₁H₁₁NO₂
Molecular Weight
189.21
Synonyms
None
SMILES
N#CC(C=1C=CC=C(C1)C(=O)O)CC
Tpsa
61.09
Logp
2.40198
H Acceptors
2
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 64379-72-2 | Benzoic acid, 3-(1-cyanopropyl)- | A2B Chem | -- |
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: C₁₁H₁₁NO₂
Molecular Weight: 189.21
Synonyms: None
SMILES: N#CC(C=1C=CC=C(C1)C(=O)O)CC
Tpsa: 61.09
Logp: 2.40198
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:
C₁₁H₁₁NO₂
Molecular Weight:
189.21
Synonyms:
None
SMILES:
N#CC(C=1C=CC=C(C1)C(=O)O)CC
Tpsa:
61.09
Logp:
2.40198
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: C₁₆H₂₀N₂O₇
Molecular Weight: 352.34
Synonyms: None
SMILES: C([C@@H]([C@@H]([C@@H](CO)O)O)O)N1C=2C(N=C(C(O)=O)C1=O)=CC(C)=C(C)C2
Tpsa: 153.11
Logp: -1.21346
H Acceptors: 8
H Donors: 5
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:
C₁₆H₂₀N₂O₇
Molecular Weight:
352.34
Synonyms:
None
SMILES:
C([C@@H]([C@@H]([C@@H](CO)O)O)O)N1C=2C(N=C(C(O)=O)C1=O)=CC(C)=C(C)C2
Tpsa:
153.11
Logp:
-1.21346
H Acceptors:
8
H Donors:
5
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: C₂₇H₂₅N₃O₃S
Molecular Weight: 471.57
Synonyms: None
SMILES: C(NC1=NC(\C(\C(OCC)=O)=N\OC)=CS1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Tpsa: 72.81
Logp: 5.4607
H Acceptors: 7
H Donors: 1
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:
C₂₇H₂₅N₃O₃S
Molecular Weight:
471.57
Synonyms:
None
SMILES:
C(NC1=NC(\C(\C(OCC)=O)=N\OC)=CS1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
Tpsa:
72.81
Logp:
5.4607
H Acceptors:
7
H Donors:
1
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: C₂₄H₂₇N₅O₃
Molecular Weight: 433.50
Synonyms: None
SMILES: O=C1C=2[N-]C(=NC2N(C(=O)N1C)C)[N+](C)(C)CCOC(C=3C=CC=CC3)C=4C=CC=CC4
Tpsa: 80.22
Logp: 1.9625
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₇N₅O₃
Molecular Weight:
433.50
Synonyms:
None
SMILES:
O=C1C=2[N-]C(=NC2N(C(=O)N1C)C)[N+](C)(C)CCOC(C=3C=CC=CC3)C=4C=CC=CC4
Tpsa:
80.22
Logp:
1.9625
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
7