CS-1001113
Ioversol Impurity 9
Manufacturer: ChemScene
CAS Number: 134768-85-7
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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
C₁₅H₁₈I₃N₃O₇
Molecular Weight
733.03
Synonyms
None
SMILES
O=C(N)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)CO)CCO
Tpsa
173.42
Logp
-1.0001
H Acceptors
7
H Donors
6
Rotatable Bonds
9
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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: C₁₅H₁₈I₃N₃O₇
Molecular Weight: 733.03
Synonyms: None
SMILES: O=C(N)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)CO)CCO
Tpsa: 173.42
Logp: -1.0001
H Acceptors: 7
H Donors: 6
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₈I₃N₃O₇
Molecular Weight:
733.03
Synonyms:
None
SMILES:
O=C(N)C=1C(I)=C(C(=O)NCC(O)CO)C(I)=C(C1I)N(C(=O)CO)CCO
Tpsa:
173.42
Logp:
-1.0001
H Acceptors:
7
H Donors:
6
Rotatable Bonds:
9
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₀FN₃O₆S
Molecular Weight: 483.55
Synonyms: None
SMILES: C(C[C@H](C[C@H](CC(O)=O)O)O)C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2
Tpsa: 140.92
Logp: 2.3211
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 11
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₃₀FN₃O₆S
Molecular Weight:
483.55
Synonyms:
None
SMILES:
C(C[C@H](C[C@H](CC(O)=O)O)O)C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2
Tpsa:
140.92
Logp:
2.3211
H Acceptors:
7
H Donors:
3
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: C₁₈H₁₈FN₃O₂
Molecular Weight: 327.35
Synonyms: None
SMILES: C(=C\1/C=2C(NC1=O)=CC=C(F)C2)\C3=C(C)C(C(N(C)C)=O)=C(C)N3
Tpsa: 65.2
Logp: 2.96514
H Acceptors: 2
H Donors: 2
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:
C₁₈H₁₈FN₃O₂
Molecular Weight:
327.35
Synonyms:
None
SMILES:
C(=C\1/C=2C(NC1=O)=CC=C(F)C2)\C3=C(C)C(C(N(C)C)=O)=C(C)N3
Tpsa:
65.2
Logp:
2.96514
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₀ClN₃O₃
Molecular Weight: 219.63
Synonyms: None
SMILES: O=N(=O)C1=CN=C(N1C(CCl)CO)C
Tpsa: 81.19
Logp: 0.87192
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀ClN₃O₃
Molecular Weight:
219.63
Synonyms:
None
SMILES:
O=N(=O)C1=CN=C(N1C(CCl)CO)C
Tpsa:
81.19
Logp:
0.87192
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4