CS-1000259
Iomeprol Impurity 3
Manufacturer: ChemScene
CAS Number: 104517-95-5
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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
C₁₇H₂₂I₃N₃O₈
Molecular Weight
777.09
Synonyms
None
SMILES
O=C(NCC(O)CO)C1=C(I)C(OCC(=O)NC)=C(I)C(C(=O)NCC(O)CO)=C1I
Tpsa
177.45
Logp
-1.2088
H Acceptors
8
H Donors
7
Rotatable Bonds
11
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: C₁₇H₂₂I₃N₃O₈
Molecular Weight: 777.09
Synonyms: None
SMILES: O=C(NCC(O)CO)C1=C(I)C(OCC(=O)NC)=C(I)C(C(=O)NCC(O)CO)=C1I
Tpsa: 177.45
Logp: -1.2088
H Acceptors: 8
H Donors: 7
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:
C₁₇H₂₂I₃N₃O₈
Molecular Weight:
777.09
Synonyms:
None
SMILES:
O=C(NCC(O)CO)C1=C(I)C(OCC(=O)NC)=C(I)C(C(=O)NCC(O)CO)=C1I
Tpsa:
177.45
Logp:
-1.2088
H Acceptors:
8
H Donors:
7
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: C₁₃H₂₅NO₄Si
Molecular Weight: 287.43
Synonyms: None
SMILES: O(C(C)=O)[C@H]1[C@]([C@H](O[Si](C(C)(C)C)(C)C)C)(C(=O)N1)[H]
Tpsa: 64.63
Logp: 2.0319
H Acceptors: 4
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:
C₁₃H₂₅NO₄Si
Molecular Weight:
287.43
Synonyms:
None
SMILES:
O(C(C)=O)[C@H]1[C@]([C@H](O[Si](C(C)(C)C)(C)C)C)(C(=O)N1)[H]
Tpsa:
64.63
Logp:
2.0319
H Acceptors:
4
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: C₁₅H₁₀N₂O₅
Molecular Weight: 298.25
Synonyms: None
SMILES: O=C(O)C1=CC=2C(=O)C3=CC(=CC=C3OC2N=C1N)C(=O)C
Tpsa: 123.49
Logp: 1.8242
H Acceptors: 6
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:
C₁₅H₁₀N₂O₅
Molecular Weight:
298.25
Synonyms:
None
SMILES:
O=C(O)C1=CC=2C(=O)C3=CC(=CC=C3OC2N=C1N)C(=O)C
Tpsa:
123.49
Logp:
1.8242
H Acceptors:
6
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: C₁₁H₁₃NO
Molecular Weight: 175.23
Synonyms: None
SMILES: N(C(/C=C/C)=O)(C)C1=CC=CC=C1
Tpsa: 20.31
Logp: 2.2255
H Acceptors: 1
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:
C₁₁H₁₃NO
Molecular Weight:
175.23
Synonyms:
None
SMILES:
N(C(/C=C/C)=O)(C)C1=CC=CC=C1
Tpsa:
20.31
Logp:
2.2255
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2