CS-0640296
4,4',4'',4''',4'''',4'''''-(5,6,7,8,13,14,15,16,21,22,23,24-Dodecadehydrotribenzo[a,g,m]cyclooctadecene-2,3,10,11,18,19-hexayl)hexakis[benzoicacid]
Manufacturer: ChemScene
CAS Number: 1670923-95-1
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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
C₇₂H₃₆O₁₂
Molecular Weight
1093.05
Synonyms
None
SMILES
O=C(O)C1=CC=C(C=C1)C=2C=C3C#CC#CC4=CC(C5=CC=C(C=C5)C(=O)O)=C(C=C4C#CC#CC6=CC(C7=CC=C(C=C7)C(=O)O)=C(C=C6C#CC#CC3=CC2C8=CC=C(C=C8)C(=O)O)C9=CC=C(C=C9)C(=O)O)C%10=CC=C(C=C%10)C(=O)O
Tpsa
223.8
Logp
14.3129
H Acceptors
6
H Donors
6
Rotatable Bonds
12
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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: C₇₂H₃₆O₁₂
Molecular Weight: 1093.05
Synonyms: None
SMILES: O=C(O)C1=CC=C(C=C1)C=2C=C3C#CC#CC4=CC(C5=CC=C(C=C5)C(=O)O)=C(C=C4C#CC#CC6=CC(C7=CC=C(C=C7)C(=O)O)=C(C=C6C#CC#CC3=CC2C8=CC=C(C=C8)C(=O)O)C9=CC=C(C=C9)C(=O)O)C%10=CC=C(C=C%10)C(=O)O
Tpsa: 223.8
Logp: 14.3129
H Acceptors: 6
H Donors: 6
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇₂H₃₆O₁₂
Molecular Weight:
1093.05
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C=C1)C=2C=C3C#CC#CC4=CC(C5=CC=C(C=C5)C(=O)O)=C(C=C4C#CC#CC6=CC(C7=CC=C(C=C7)C(=O)O)=C(C=C6C#CC#CC3=CC2C8=CC=C(C=C8)C(=O)O)C9=CC=C(C=C9)C(=O)O)C%10=CC=C(C=C%10)C(=O)O
Tpsa:
223.8
Logp:
14.3129
H Acceptors:
6
H Donors:
6
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₃NO₅
Molecular Weight: 157.08
Synonyms: None
SMILES: C1=C(ON=C1C(=O)O)C(=O)O
Tpsa: 100.63
Logp: 0.071
H Acceptors: 4
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:
C₅H₃NO₅
Molecular Weight:
157.08
Synonyms:
None
SMILES:
C1=C(ON=C1C(=O)O)C(=O)O
Tpsa:
100.63
Logp:
0.071
H Acceptors:
4
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: C₂₆H₁₆N₂O₄
Molecular Weight: 420.42
Synonyms: None
SMILES: N#CC(=CC1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)O
Tpsa: 122.18
Logp: 5.21136
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:
C₂₆H₁₆N₂O₄
Molecular Weight:
420.42
Synonyms:
None
SMILES:
N#CC(=CC1=CC=C(C=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)C(=O)O
Tpsa:
122.18
Logp:
5.21136
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: C₃₀H₂₂O₄
Molecular Weight: 446.49
Synonyms: None
SMILES: O=C(O)C1=CC=C(C=C1)C(=CC=C(C=2C=CC=CC2)C3=CC=C(C=C3)C(=O)O)C=4C=CC=CC4
Tpsa: 74.6
Logp: 6.6466
H Acceptors: 2
H Donors: 2
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:
C₃₀H₂₂O₄
Molecular Weight:
446.49
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C=C1)C(=CC=C(C=2C=CC=CC2)C3=CC=C(C=C3)C(=O)O)C=4C=CC=CC4
Tpsa:
74.6
Logp:
6.6466
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
7