CS-0642445
(S)-5,5'-(2-Methylpiperazine-1,4-diyl)diisophthalic acid
Manufacturer: ChemScene
CAS Number: 2093110-57-5
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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
C₂₁H₂₀N₂O₈
Molecular Weight
428.39
Synonyms
None
SMILES
C[C@@H]1N(C2=CC(C(O)=O)=CC(C(O)=O)=C2)CCN(C3=CC(C(O)=O)=CC(C(O)=O)=C3)C1
Tpsa
155.68
Logp
2.1945
H Acceptors
6
H Donors
4
Rotatable Bonds
6
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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: C₂₁H₂₀N₂O₈
Molecular Weight: 428.39
Synonyms: None
SMILES: C[C@@H]1N(C2=CC(C(O)=O)=CC(C(O)=O)=C2)CCN(C3=CC(C(O)=O)=CC(C(O)=O)=C3)C1
Tpsa: 155.68
Logp: 2.1945
H Acceptors: 6
H Donors: 4
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:
C₂₁H₂₀N₂O₈
Molecular Weight:
428.39
Synonyms:
None
SMILES:
C[C@@H]1N(C2=CC(C(O)=O)=CC(C(O)=O)=C2)CCN(C3=CC(C(O)=O)=CC(C(O)=O)=C3)C1
Tpsa:
155.68
Logp:
2.1945
H Acceptors:
6
H Donors:
4
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: C₃₂H₂₂N₂O₄
Molecular Weight: 498.53
Synonyms: None
SMILES: O=C(C1=CC=C(N2C(C3=CC=CC=C3)=CC4=C2C=C(N4C5=CC=C(C(O)=O)C=C5)C6=CC=CC=C6)C=C1)O
Tpsa: 84.46
Logp: 7.1516
H Acceptors: 4
H Donors: 2
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:
C₃₂H₂₂N₂O₄
Molecular Weight:
498.53
Synonyms:
None
SMILES:
O=C(C1=CC=C(N2C(C3=CC=CC=C3)=CC4=C2C=C(N4C5=CC=C(C(O)=O)C=C5)C6=CC=CC=C6)C=C1)O
Tpsa:
84.46
Logp:
7.1516
H Acceptors:
4
H Donors:
2
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: C₂₂H₁₃NO₁₀
Molecular Weight: 451.34
Synonyms: None
SMILES: O=C(C1=CC(C2=CC(N(=O)=O)=C(C3=CC(C(O)=O)=CC(C(O)=O)=C3)C=C2)=CC(C(O)=O)=C1)O
Tpsa: 192.34
Logp: 3.7216
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₁₃NO₁₀
Molecular Weight:
451.34
Synonyms:
None
SMILES:
O=C(C1=CC(C2=CC(N(=O)=O)=C(C3=CC(C(O)=O)=CC(C(O)=O)=C3)C=C2)=CC(C(O)=O)=C1)O
Tpsa:
192.34
Logp:
3.7216
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₁₈O₆
Molecular Weight: 390.39
Synonyms: None
SMILES: O=C(C1=CC=C(C(C2=CC=C(C(O)=O)C=C2)(C)C3=CC=C(C(O)=O)C=C3)C=C1)O
Tpsa: 111.9
Logp: 4.1355
H Acceptors: 3
H Donors: 3
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:
C₂₃H₁₈O₆
Molecular Weight:
390.39
Synonyms:
None
SMILES:
O=C(C1=CC=C(C(C2=CC=C(C(O)=O)C=C2)(C)C3=CC=C(C(O)=O)C=C3)C=C1)O
Tpsa:
111.9
Logp:
4.1355
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
6