CS-0608770
5-(2-(2,4-Difluorophenyl)-1-hydroxyethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione Sitagliptin Impurity
Manufacturer: ChemScene
CAS Number: None
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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
C₁₄H₁₂F₂O₅
Molecular Weight
298.24
Synonyms
None
SMILES
O=C(OC(C)(C)OC/1=O)C1=C(O)/CC2=CC=C(F)C=C2F
Tpsa
72.83
Logp
2.1555
H Acceptors
5
H Donors
1
Rotatable Bonds
2
Other Options
...
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: C₁₄H₁₂F₂O₅
Molecular Weight: 298.24
Synonyms: None
SMILES: O=C(OC(C)(C)OC/1=O)C1=C(O)/CC2=CC=C(F)C=C2F
Tpsa: 72.83
Logp: 2.1555
H Acceptors: 5
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:
C₁₄H₁₂F₂O₅
Molecular Weight:
298.24
Synonyms:
None
SMILES:
O=C(OC(C)(C)OC/1=O)C1=C(O)/CC2=CC=C(F)C=C2F
Tpsa:
72.83
Logp:
2.1555
H Acceptors:
5
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: C₅H₁₀Cl₂N₂S
Molecular Weight: 201.12
Synonyms: 1-(1,3-Thiazol-5-yl)ethanamine; dihydrochloride
SMILES: NC(C)C1=CN=CS1.Cl.Cl
Tpsa: 38.91
Logp: 2.0064
H Acceptors: 3
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:
C₅H₁₀Cl₂N₂S
Molecular Weight:
201.12
Synonyms:
1-(1,3-Thiazol-5-yl)ethanamine; dihydrochloride
SMILES:
NC(C)C1=CN=CS1.Cl.Cl
Tpsa:
38.91
Logp:
2.0064
H Acceptors:
3
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: C₁₀H₇F₃O₃
Molecular Weight: 232.16
Synonyms: None
SMILES: O=C(CC(O)=O)CC1=CC(F)=C(F)C=C1F
Tpsa: 54.37
Logp: 1.6902
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇F₃O₃
Molecular Weight:
232.16
Synonyms:
None
SMILES:
O=C(CC(O)=O)CC1=CC(F)=C(F)C=C1F
Tpsa:
54.37
Logp:
1.6902
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈ClFN₄
Molecular Weight: 214.63
Synonyms: 2-FLUORO-6-CHLORO-9-(1-METHYLETHYL)-9H-PURINE(WX130403)
SMILES: ClC1=C2C(N(C=N2)C(C)C)=NC(F)=N1
Tpsa: 43.6
Logp: 2.1997
H Acceptors: 4
H Donors: 0
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:
C₈H₈ClFN₄
Molecular Weight:
214.63
Synonyms:
2-FLUORO-6-CHLORO-9-(1-METHYLETHYL)-9H-PURINE(WX130403)
SMILES:
ClC1=C2C(N(C=N2)C(C)C)=NC(F)=N1
Tpsa:
43.6
Logp:
2.1997
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1