CS-1004595
Aadobenate Dimeglumine Impurity 3
Manufacturer: ChemScene
CAS Number: 70312-72-0
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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
C₁₆H₂₇N₃O₁₀
Molecular Weight
421.40
Synonyms
None
SMILES
O=C(O)CN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC(=O)OCC
Tpsa
185.22
Logp
-2.2061
H Acceptors
9
H Donors
4
Rotatable Bonds
17
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: C₁₆H₂₇N₃O₁₀
Molecular Weight: 421.40
Synonyms: None
SMILES: O=C(O)CN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC(=O)OCC
Tpsa: 185.22
Logp: -2.2061
H Acceptors: 9
H Donors: 4
Rotatable Bonds: 17
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₇N₃O₁₀
Molecular Weight:
421.40
Synonyms:
None
SMILES:
O=C(O)CN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC(=O)OCC
Tpsa:
185.22
Logp:
-2.2061
H Acceptors:
9
H Donors:
4
Rotatable Bonds:
17
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇NO₃
Molecular Weight: 235.28
Synonyms: None
SMILES: O=CN(CC(=O)OCC)C(C=1C=CC=CC1)C
Tpsa: 46.61
Logp: 1.7691
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₃
Molecular Weight:
235.28
Synonyms:
None
SMILES:
O=CN(CC(=O)OCC)C(C=1C=CC=CC1)C
Tpsa:
46.61
Logp:
1.7691
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₃ClO₄
Molecular Weight: 302.79
Synonyms: None
SMILES: ClCC(O)COC1=CC=C(C=C1)COCCOC(C)C
Tpsa: 47.92
Logp: 2.6067
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₃ClO₄
Molecular Weight:
302.79
Synonyms:
None
SMILES:
ClCC(O)COC1=CC=C(C=C1)COCCOC(C)C
Tpsa:
47.92
Logp:
2.6067
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
10
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₃₂N₄O₆
Molecular Weight: 496.56
Synonyms: None
SMILES: O=C1C=2C(O)=CC=C(O)C2C(=O)C=3C(=CC=C(NCCN4CCOCC4)C13)NCCN5CCOCC5
Tpsa: 123.6
Logp: 1.3614
H Acceptors: 10
H Donors: 4
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:
C₂₆H₃₂N₄O₆
Molecular Weight:
496.56
Synonyms:
None
SMILES:
O=C1C=2C(O)=CC=C(O)C2C(=O)C=3C(=CC=C(NCCN4CCOCC4)C13)NCCN5CCOCC5
Tpsa:
123.6
Logp:
1.3614
H Acceptors:
10
H Donors:
4
Rotatable Bonds:
8