CS-1002055
Gadobutrol Impurity 177
Manufacturer: ChemScene
CAS Number: 176666-91-4
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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
C₁₆H₂₄CaN₄O₈ ₂-
Molecular Weight
440.46
Synonyms
None
SMILES
O=C1[O-][Ca+2]234567[O-]C(=O)C[N]87CC[N]6(C1)CC[N]5(CC(=O)[O-]2)CC[N]4(CC(=O)[O-]3)CC8
Tpsa
N/A
Logp
N/A
H Acceptors
N/A
H Donors
N/A
Rotatable Bonds
N/A
Related Products
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: C₁₆H₂₄CaN₄O₈ ₂-
Molecular Weight: 440.46
Synonyms: None
SMILES: O=C1[O-][Ca+2]234567[O-]C(=O)C[N]87CC[N]6(C1)CC[N]5(CC(=O)[O-]2)CC[N]4(CC(=O)[O-]3)CC8
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₄CaN₄O₈ ₂-
Molecular Weight:
440.46
Synonyms:
None
SMILES:
O=C1[O-][Ca+2]234567[O-]C(=O)C[N]87CC[N]6(C1)CC[N]5(CC(=O)[O-]2)CC[N]4(CC(=O)[O-]3)CC8
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₈N₄O₃
Molecular Weight: 276.38
Synonyms: None
SMILES: OCC(O)C(N1CCNCCNCCNCC1)CO
Tpsa: 100.02
Logp: -3.2151
H Acceptors: 7
H Donors: 6
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:
C₁₂H₂₈N₄O₃
Molecular Weight:
276.38
Synonyms:
None
SMILES:
OCC(O)C(N1CCNCCNCCNCC1)CO
Tpsa:
100.02
Logp:
-3.2151
H Acceptors:
7
H Donors:
6
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: C₆H₁₂O₄
Molecular Weight: 148.16
Synonyms: None
SMILES: O(C)[C@H]1C[C@H](O)[C@H](O)CO1
Tpsa: 58.92
Logp: -0.899
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₂O₄
Molecular Weight:
148.16
Synonyms:
None
SMILES:
O(C)[C@H]1C[C@H](O)[C@H](O)CO1
Tpsa:
58.92
Logp:
-0.899
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₃N₃O₂
Molecular Weight: 277.36
Synonyms: None
SMILES: O=C(NCC1N(CC)CCC1)C2=CC=C(N)C=C2OC
Tpsa: 67.59
Logp: 1.4915
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₃N₃O₂
Molecular Weight:
277.36
Synonyms:
None
SMILES:
O=C(NCC1N(CC)CCC1)C2=CC=C(N)C=C2OC
Tpsa:
67.59
Logp:
1.4915
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5