CS-1000878
Ioversol Impurity 11
Manufacturer: ChemScene
CAS Number: 126736-35-4
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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
C₁₉H₂₆I₃N₃O₉
Molecular Weight
821.14
Synonyms
None
SMILES
O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)COC)CCO
Tpsa
188.89
Logp
-1.3619
H Acceptors
9
H Donors
7
Rotatable Bonds
13
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: C₁₉H₂₆I₃N₃O₉
Molecular Weight: 821.14
Synonyms: None
SMILES: O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)COC)CCO
Tpsa: 188.89
Logp: -1.3619
H Acceptors: 9
H Donors: 7
Rotatable Bonds: 13
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₆I₃N₃O₉
Molecular Weight:
821.14
Synonyms:
None
SMILES:
O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)COC)CCO
Tpsa:
188.89
Logp:
-1.3619
H Acceptors:
9
H Donors:
7
Rotatable Bonds:
13
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃NO₃
Molecular Weight: 231.25
Synonyms: None
SMILES: C(OCC1=CC=CC=C1)(=O)N2[C@@]3(C[C@](O2)(C=C3)[H])[H]
Tpsa: 38.77
Logp: 2.2675
H Acceptors: 3
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:
C₁₃H₁₃NO₃
Molecular Weight:
231.25
Synonyms:
None
SMILES:
C(OCC1=CC=CC=C1)(=O)N2[C@@]3(C[C@](O2)(C=C3)[H])[H]
Tpsa:
38.77
Logp:
2.2675
H Acceptors:
3
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: C₁₉H₂₂FN₃O₄
Molecular Weight: 375.39
Synonyms: None
SMILES: O=C1C=2C3=C(C(=C(F)C2)N4CCN(C)CC4)OC[C@@H](C)N3C=C1C(OC)=O
Tpsa: 64.01
Logp: 1.6324
H Acceptors: 7
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:
C₁₉H₂₂FN₃O₄
Molecular Weight:
375.39
Synonyms:
None
SMILES:
O=C1C=2C3=C(C(=C(F)C2)N4CCN(C)CC4)OC[C@@H](C)N3C=C1C(OC)=O
Tpsa:
64.01
Logp:
1.6324
H Acceptors:
7
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: C₁₃H₇BrOS
Molecular Weight: 291.16
Synonyms: None
SMILES: O=C1C=2C=CC=CC2C=CC=3SC(Br)=CC31
Tpsa: 17.07
Logp: 4.1772
H Acceptors: 2
H Donors: 0
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:
C₁₃H₇BrOS
Molecular Weight:
291.16
Synonyms:
None
SMILES:
O=C1C=2C=CC=CC2C=CC=3SC(Br)=CC31
Tpsa:
17.07
Logp:
4.1772
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0