CS-1004875
Sitagliptin Impurity 94
Manufacturer: ChemScene
CAS Number: 792936-35-7
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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
C₁₅H₁₆F₃NO₂
Molecular Weight
299.29
Synonyms
None
SMILES
O=C(N1CCCCC1)CC(=O)CC2=CC(F)=C(F)C=C2F
Tpsa
37.38
Logp
2.6181
H Acceptors
2
H Donors
0
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 792936-35-7 | | A2B Chem | -- |
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: C₁₅H₁₆F₃NO₂
Molecular Weight: 299.29
Synonyms: None
SMILES: O=C(N1CCCCC1)CC(=O)CC2=CC(F)=C(F)C=C2F
Tpsa: 37.38
Logp: 2.6181
H Acceptors: 2
H Donors: 0
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:
C₁₅H₁₆F₃NO₂
Molecular Weight:
299.29
Synonyms:
None
SMILES:
O=C(N1CCCCC1)CC(=O)CC2=CC(F)=C(F)C=C2F
Tpsa:
37.38
Logp:
2.6181
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂N₄O₃
Molecular Weight: 212.21
Synonyms: None
SMILES: O=C(N)C1=C(C(=NN1C)C(C)C)N(=O)=O
Tpsa: 104.05
Logp: 0.5506
H Acceptors: 5
H Donors: 1
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:
C₈H₁₂N₄O₃
Molecular Weight:
212.21
Synonyms:
None
SMILES:
O=C(N)C1=C(C(=NN1C)C(C)C)N(=O)=O
Tpsa:
104.05
Logp:
0.5506
H Acceptors:
5
H Donors:
1
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: C₁₅H₁₃NO₄S
Molecular Weight: 303.33
Synonyms: None
SMILES: C(\C(=C\C1=CC=CC=C1)\C)=C\2/C(=O)N(CC(O)=O)C(=O)S2
Tpsa: 74.68
Logp: 2.7538
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₃NO₄S
Molecular Weight:
303.33
Synonyms:
None
SMILES:
C(\C(=C\C1=CC=CC=C1)\C)=C\2/C(=O)N(CC(O)=O)C(=O)S2
Tpsa:
74.68
Logp:
2.7538
H Acceptors:
4
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: C₂₇H₃₁NO₉
Molecular Weight: 513.54
Synonyms: 13-Deoxydaunorubicin
SMILES: OC1=C(C(C2=CC=CC(OC)=C2C3=O)=O)C3=C(O)C4=C1C[C@](CC)(O)C[C@@H]4O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)N
Tpsa: 168.77
Logp: 1.8499
H Acceptors: 10
H Donors: 5
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:
C₂₇H₃₁NO₉
Molecular Weight:
513.54
Synonyms:
13-Deoxydaunorubicin
SMILES:
OC1=C(C(C2=CC=CC(OC)=C2C3=O)=O)C3=C(O)C4=C1C[C@](CC)(O)C[C@@H]4O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)N
Tpsa:
168.77
Logp:
1.8499
H Acceptors:
10
H Donors:
5
Rotatable Bonds:
4