CS-0170488
5-((4-Carboxyphenyl)ethynyl)isophthalicacid
Manufacturer: ChemScene
CAS Number: 1311146-60-7
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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
C₁₇H₁₀O₆
Molecular Weight
310.26
Synonyms
5-(2-(4-carboxyphenyl)ethynyl)benzene-1,3-dioic acid
SMILES
O=C(C1=CC(C#CC2=CC=C(C(O)=O)C=C2)=CC(C(O)=O)=C1)O
Tpsa
111.9
Logp
2.181
H Acceptors
3
H Donors
3
Rotatable Bonds
3
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: C₁₇H₁₀O₆
Molecular Weight: 310.26
Synonyms: 5-(2-(4-carboxyphenyl)ethynyl)benzene-1,3-dioic acid
SMILES: O=C(C1=CC(C#CC2=CC=C(C(O)=O)C=C2)=CC(C(O)=O)=C1)O
Tpsa: 111.9
Logp: 2.181
H Acceptors: 3
H Donors: 3
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:
C₁₇H₁₀O₆
Molecular Weight:
310.26
Synonyms:
5-(2-(4-carboxyphenyl)ethynyl)benzene-1,3-dioic acid
SMILES:
O=C(C1=CC(C#CC2=CC=C(C(O)=O)C=C2)=CC(C(O)=O)=C1)O
Tpsa:
111.9
Logp:
2.181
H Acceptors:
3
H Donors:
3
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: C₁₇H₁₂N₂O₉
Molecular Weight: 388.29
Synonyms: 5,5'-(carbonylbis(azanediyl))diisophthalic acid
SMILES: O=C(NC1=CC(C(O)=O)=CC(C(O)=O)=C1)NC2=CC(C(O)=O)=CC(C(O)=O)=C2
Tpsa: 190.33
Logp: 2.1234
H Acceptors: 5
H Donors: 6
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:
C₁₇H₁₂N₂O₉
Molecular Weight:
388.29
Synonyms:
5,5'-(carbonylbis(azanediyl))diisophthalic acid
SMILES:
O=C(NC1=CC(C(O)=O)=CC(C(O)=O)=C1)NC2=CC(C(O)=O)=CC(C(O)=O)=C2
Tpsa:
190.33
Logp:
2.1234
H Acceptors:
5
H Donors:
6
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: C₂₆H₁₆O₈
Molecular Weight: 456.40
Synonyms: 1,3-Benzenedicarboxylic acid, 5,5'-(1,5-naphthalenediyl)bis-
SMILES: O=C(C1=CC(C2=C3C=CC=C(C4=CC(C(O)=O)=CC(C(O)=O)=C4)C3=CC=C2)=CC(C(O)=O)=C1)O
Tpsa: 149.2
Logp: 4.9666
H Acceptors: 4
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:
C₂₆H₁₆O₈
Molecular Weight:
456.40
Synonyms:
1,3-Benzenedicarboxylic acid, 5,5'-(1,5-naphthalenediyl)bis-
SMILES:
O=C(C1=CC(C2=C3C=CC=C(C4=CC(C(O)=O)=CC(C(O)=O)=C4)C3=CC=C2)=CC(C(O)=O)=C1)O
Tpsa:
149.2
Logp:
4.9666
H Acceptors:
4
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: C₁₁H₁₀O₅
Molecular Weight: 222.19
Synonyms: 1,3-Benzenedicarboxylic acid, 5-(2-propenyloxy)-
SMILES: O=C(C1=CC(OCC=C)=CC(C(O)=O)=C1)O
Tpsa: 83.83
Logp: 1.6478
H Acceptors: 3
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:
C₁₁H₁₀O₅
Molecular Weight:
222.19
Synonyms:
1,3-Benzenedicarboxylic acid, 5-(2-propenyloxy)-
SMILES:
O=C(C1=CC(OCC=C)=CC(C(O)=O)=C1)O
Tpsa:
83.83
Logp:
1.6478
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
5