CS-1002386
Iomeprol Impurity 2
Manufacturer: ChemScene
CAS Number: 196309-10-1
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₂₁I₂N₃O₈
Molecular Weight
649.17
Synonyms
None
SMILES
O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C=2OCC(=O)N(C2C1I)C
Tpsa
168.66
Logp
-1.583
H Acceptors
8
H Donors
6
Rotatable Bonds
8
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₁I₂N₃O₈
Molecular Weight: 649.17
Synonyms: None
SMILES: O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C=2OCC(=O)N(C2C1I)C
Tpsa: 168.66
Logp: -1.583
H Acceptors: 8
H Donors: 6
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₁I₂N₃O₈
Molecular Weight:
649.17
Synonyms:
None
SMILES:
O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C=2OCC(=O)N(C2C1I)C
Tpsa:
168.66
Logp:
-1.583
H Acceptors:
8
H Donors:
6
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: C₁₈H₂₂IN₃O₉
Molecular Weight: 551.29
Synonyms: None
SMILES: O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C=2OCCN3C(=O)COC1C23
Tpsa: 177.89
Logp: -2.425
H Acceptors: 9
H Donors: 6
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:
C₁₈H₂₂IN₃O₉
Molecular Weight:
551.29
Synonyms:
None
SMILES:
O=C(NCC(O)CO)C=1C(I)=C(C(=O)NCC(O)CO)C=2OCCN3C(=O)COC1C23
Tpsa:
177.89
Logp:
-2.425
H Acceptors:
9
H Donors:
6
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: C₂₆H₃₁NO₃S₂
Molecular Weight: 469.66
Synonyms: None
SMILES: O(S(=O)(=O)C1=CC=C(C)C=C1)C2=C3C(C[C@@H](N(CCC4=CC=CS4)CCC)CC3)=CC=C2
Tpsa: 46.61
Logp: 5.63622
H Acceptors: 5
H Donors: 0
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:
C₂₆H₃₁NO₃S₂
Molecular Weight:
469.66
Synonyms:
None
SMILES:
O(S(=O)(=O)C1=CC=C(C)C=C1)C2=C3C(C[C@@H](N(CCC4=CC=CS4)CCC)CC3)=CC=C2
Tpsa:
46.61
Logp:
5.63622
H Acceptors:
5
H Donors:
0
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: C₁₅H₂₀N₂O₄S
Molecular Weight: 324.40
Synonyms: None
SMILES: C(NC(COC1=CC=CC=C1)=O)[C@@H]2N[C@@H](C(O)=O)C(C)(C)S2
Tpsa: 87.66
Logp: 1.0759
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 6
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₀N₂O₄S
Molecular Weight:
324.40
Synonyms:
None
SMILES:
C(NC(COC1=CC=CC=C1)=O)[C@@H]2N[C@@H](C(O)=O)C(C)(C)S2
Tpsa:
87.66
Logp:
1.0759
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
6