CS-0497663
Sodium (6R,7S)-3-(acetoxymethyl)-7-((Z)-2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Cefotaxime 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
C₁₆H₁₆N₅NaO₇S₂
Molecular Weight
477.45
Synonyms
None
SMILES
O=C(C)OCC1=C(C(O[Na])=O)N(C([C@]2([H])NC(/C(C3=CSC(N)=N3)=N\OC)=O)=O)[C@]2([H])SC1
Tpsa
162.51
Logp
-1.0804
H Acceptors
12
H Donors
2
Rotatable Bonds
7
Other Options
...
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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: C₁₆H₁₆N₅NaO₇S₂
Molecular Weight: 477.45
Synonyms: None
SMILES: O=C(C)OCC1=C(C(O[Na])=O)N(C([C@]2([H])NC(/C(C3=CSC(N)=N3)=N\OC)=O)=O)[C@]2([H])SC1
Tpsa: 162.51
Logp: -1.0804
H Acceptors: 12
H Donors: 2
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:
C₁₆H₁₆N₅NaO₇S₂
Molecular Weight:
477.45
Synonyms:
None
SMILES:
O=C(C)OCC1=C(C(O[Na])=O)N(C([C@]2([H])NC(/C(C3=CSC(N)=N3)=N\OC)=O)=O)[C@]2([H])SC1
Tpsa:
162.51
Logp:
-1.0804
H Acceptors:
12
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: MFCD00075491
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₇BrO₂
Molecular Weight: 237.13
Synonyms: 2,5,5-Trimethyl-2-(2-bromoethyl)-1,3-dioxane
SMILES: CC1(C)COC(C)(CCBr)OC1
Tpsa: 18.46
Logp: 2.5606
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD00075491
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₇BrO₂
Molecular Weight:
237.13
Synonyms:
2,5,5-Trimethyl-2-(2-bromoethyl)-1,3-dioxane
SMILES:
CC1(C)COC(C)(CCBr)OC1
Tpsa:
18.46
Logp:
2.5606
H Acceptors:
2
H Donors:
0
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: C₁₅H₁₅N₅O₈S₂
Molecular Weight: 457.44
Synonyms: None
SMILES: OC(C1=C(CO)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)=O)=O
Tpsa: 204.74
Logp: -1.7385
H Acceptors: 11
H Donors: 5
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₅N₅O₈S₂
Molecular Weight:
457.44
Synonyms:
None
SMILES:
OC(C1=C(CO)CS[C@@]2([H])N1C([C@@]2([H])NC(/C(C3=CSC(N)=N3)=N\OCC(O)=O)=O)=O)=O
Tpsa:
204.74
Logp:
-1.7385
H Acceptors:
11
H Donors:
5
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈F₂O₂
Molecular Weight: 186.16
Synonyms: None
SMILES: FC1=CC=C(OC[C@H]2OC2)C=C1F
Tpsa: 21.76
Logp: 1.7424
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:
C₉H₈F₂O₂
Molecular Weight:
186.16
Synonyms:
None
SMILES:
FC1=CC=C(OC[C@H]2OC2)C=C1F
Tpsa:
21.76
Logp:
1.7424
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3