CS-1002621
Cefotaxime Impurity 68
Manufacturer: ChemScene
CAS Number: 2133018-70-7
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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
C₃₁H₂₉N₃O₅S₃
Molecular Weight
619.77
Synonyms
None
SMILES
S(SC1=NC=2C(S1)=CC=CC2)[C@H]3N(C(C(OCC4=CC=C(OC)C=C4)=O)C(C)=C)C(=O)[C@H]3NC(CC5=CC=CC=C5)=O
Tpsa
97.83
Logp
5.6291
H Acceptors
9
H Donors
1
Rotatable Bonds
12
SAFETY INFORMATION
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: C₃₁H₂₉N₃O₅S₃
Molecular Weight: 619.77
Synonyms: None
SMILES: S(SC1=NC=2C(S1)=CC=CC2)[C@H]3N(C(C(OCC4=CC=C(OC)C=C4)=O)C(C)=C)C(=O)[C@H]3NC(CC5=CC=CC=C5)=O
Tpsa: 97.83
Logp: 5.6291
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₂₉N₃O₅S₃
Molecular Weight:
619.77
Synonyms:
None
SMILES:
S(SC1=NC=2C(S1)=CC=CC2)[C@H]3N(C(C(OCC4=CC=C(OC)C=C4)=O)C(C)=C)C(=O)[C@H]3NC(CC5=CC=CC=C5)=O
Tpsa:
97.83
Logp:
5.6291
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₃ClO
Molecular Weight: 302.84
Synonyms: None
SMILES: ClC1=CC=C(C=C1CC2=CC=C(OCC)C=C2)CCCC
Tpsa: 9.23
Logp: 5.6721
H Acceptors: 1
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:
C₁₉H₂₃ClO
Molecular Weight:
302.84
Synonyms:
None
SMILES:
ClC1=CC=C(C=C1CC2=CC=C(OCC)C=C2)CCCC
Tpsa:
9.23
Logp:
5.6721
H Acceptors:
1
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: C₂₂H₂₇ClO₇
Molecular Weight: 438.90
Synonyms: None
SMILES: O(C)C1(O[C@]([C@@H](CO)O)([C@H](O)[C@H]1O)[H])C2=CC(CC3=CC=C(OCC)C=C3)=C(Cl)C=C2
Tpsa: 108.61
Logp: 1.6025
H Acceptors: 7
H Donors: 4
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:
C₂₂H₂₇ClO₇
Molecular Weight:
438.90
Synonyms:
None
SMILES:
O(C)C1(O[C@]([C@@H](CO)O)([C@H](O)[C@H]1O)[H])C2=CC(CC3=CC=C(OCC)C=C3)=C(Cl)C=C2
Tpsa:
108.61
Logp:
1.6025
H Acceptors:
7
H Donors:
4
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: C₄₄H₄₈F₂N₈O₄
Molecular Weight: 790.90
Synonyms: None
SMILES: C([C@@]1(C[C@@H](COC2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)N5C(=O)N([C@H]([C@@H](OCC6=CC=CC=C6)C)CC)N=C5)CO1)C7=C(F)C=C(F)C=C7)N8C=NC=N8
Tpsa: 104.7
Logp: 6.7977
H Acceptors: 12
H Donors: 0
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₄H₄₈F₂N₈O₄
Molecular Weight:
790.90
Synonyms:
None
SMILES:
C([C@@]1(C[C@@H](COC2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)N5C(=O)N([C@H]([C@@H](OCC6=CC=CC=C6)C)CC)N=C5)CO1)C7=C(F)C=C(F)C=C7)N8C=NC=N8
Tpsa:
104.7
Logp:
6.7977
H Acceptors:
12
H Donors:
0
Rotatable Bonds:
15