CS-0640953
4,4',4'',4'''-((2,2',4,4',6,6'-Hexamethyl-[1,1'-biphenyl]-3,3',5,5'-tetrayl)tetrakis(ethyne-2,1-diyl))tetrabenzoicacid
Manufacturer: ChemScene
CAS Number: 2306825-07-8
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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
C₅₄H₃₈O₈
Molecular Weight
814.87
Synonyms
None
SMILES
O=C(O)C1=CC=C(C#CC=2C(=C(C#CC3=CC=C(C=C3)C(=O)O)C(=C(C=4C(=C(C#CC5=CC=C(C=C5)C(=O)O)C(=C(C#CC6=CC=C(C=C6)C(=O)O)C4C)C)C)C2C)C)C)C=C1
Tpsa
149.2
Logp
9.59612
H Acceptors
4
H Donors
4
Rotatable Bonds
5
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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: C₅₄H₃₈O₈
Molecular Weight: 814.87
Synonyms: None
SMILES: O=C(O)C1=CC=C(C#CC=2C(=C(C#CC3=CC=C(C=C3)C(=O)O)C(=C(C=4C(=C(C#CC5=CC=C(C=C5)C(=O)O)C(=C(C#CC6=CC=C(C=C6)C(=O)O)C4C)C)C)C2C)C)C)C=C1
Tpsa: 149.2
Logp: 9.59612
H Acceptors: 4
H Donors: 4
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:
C₅₄H₃₈O₈
Molecular Weight:
814.87
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C#CC=2C(=C(C#CC3=CC=C(C=C3)C(=O)O)C(=C(C=4C(=C(C#CC5=CC=C(C=C5)C(=O)O)C(=C(C#CC6=CC=C(C=C6)C(=O)O)C4C)C)C)C2C)C)C)C=C1
Tpsa:
149.2
Logp:
9.59612
H Acceptors:
4
H Donors:
4
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: C₅₈H₄₀N₂O₈
Molecular Weight: 892.95
Synonyms: None
SMILES: O=C(O)C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)O)C5=CC=C(C=C5)N(C6=CC=C(C=C6)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C9=CC=C(C=C9)C(=O)O
Tpsa: 155.68
Logp: 14.087
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₈H₄₀N₂O₈
Molecular Weight:
892.95
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)O)C5=CC=C(C=C5)N(C6=CC=C(C=C6)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C9=CC=C(C=C9)C(=O)O
Tpsa:
155.68
Logp:
14.087
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
14
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁NO₃
Molecular Weight: 229.23
Synonyms: None
SMILES: O=C(O)C1=CC=CC(=O)N1CC=2C=CC=CC2
Tpsa: 59.3
Logp: 1.5948
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₁NO₃
Molecular Weight:
229.23
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC(=O)N1CC=2C=CC=CC2
Tpsa:
59.3
Logp:
1.5948
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄O₅
Molecular Weight: 238.24
Synonyms: None
SMILES: O=C(OC1=CC=C(C=C1)C(=O)O)OC(C)(C)C
Tpsa: 72.83
Logp: 2.6987
H Acceptors: 4
H Donors: 1
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:
C₁₂H₁₄O₅
Molecular Weight:
238.24
Synonyms:
None
SMILES:
O=C(OC1=CC=C(C=C1)C(=O)O)OC(C)(C)C
Tpsa:
72.83
Logp:
2.6987
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2