CS-1000514
Gadobutrol Impurity 168
Manufacturer: ChemScene
CAS Number: 114873-54-0
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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
C₂₂H₄₀N₄O₈
Molecular Weight
488.58
Synonyms
None
SMILES
O=C(O)CN1CCN(CC(=O)OCC)CCN(CC(=O)OCC)CCN(CC(=O)OCC)CC1
Tpsa
129.16
Logp
-1.0181
H Acceptors
11
H Donors
1
Rotatable Bonds
11
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 114873-54-0 | | A2B Chem | -- |
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: C₂₂H₄₀N₄O₈
Molecular Weight: 488.58
Synonyms: None
SMILES: O=C(O)CN1CCN(CC(=O)OCC)CCN(CC(=O)OCC)CCN(CC(=O)OCC)CC1
Tpsa: 129.16
Logp: -1.0181
H Acceptors: 11
H Donors: 1
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₄₀N₄O₈
Molecular Weight:
488.58
Synonyms:
None
SMILES:
O=C(O)CN1CCN(CC(=O)OCC)CCN(CC(=O)OCC)CCN(CC(=O)OCC)CC1
Tpsa:
129.16
Logp:
-1.0181
H Acceptors:
11
H Donors:
1
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆N₂O₂
Molecular Weight: 150.13
Synonyms: None
SMILES: N#CC1=CC(O)=C(O)C=C1N
Tpsa: 90.27
Logp: 0.55168
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆N₂O₂
Molecular Weight:
150.13
Synonyms:
None
SMILES:
N#CC1=CC(O)=C(O)C=C1N
Tpsa:
90.27
Logp:
0.55168
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁NO₆
Molecular Weight: 193.15
Synonyms: None
SMILES: C(O)(=O)[C@@H]1[C@@H](O)[C@H](O)[C@@H](N)[C@H](O)O1
Tpsa: 133.24
Logp: -3.1627
H Acceptors: 6
H Donors: 5
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:
C₆H₁₁NO₆
Molecular Weight:
193.15
Synonyms:
None
SMILES:
C(O)(=O)[C@@H]1[C@@H](O)[C@H](O)[C@@H](N)[C@H](O)O1
Tpsa:
133.24
Logp:
-3.1627
H Acceptors:
6
H Donors:
5
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: C₁₃H₁₇N₃O₂S
Molecular Weight: 279.36
Synonyms: None
SMILES: O=C(OC)NC1=NC=2C=CC(SCCC)=CC2N1C
Tpsa: 56.15
Logp: 3.2537
H Acceptors: 5
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:
C₁₃H₁₇N₃O₂S
Molecular Weight:
279.36
Synonyms:
None
SMILES:
O=C(OC)NC1=NC=2C=CC(SCCC)=CC2N1C
Tpsa:
56.15
Logp:
3.2537
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4