CS-0564981
4′,4′′′,4′′′′′,4′′′′′′′-(21H,23H-Porphine-5,10,15,20-tetrayl)tetrakis-[1,1′-Biphenyl]-3,5-dicarboxylic acid
Manufacturer: ChemScene
CAS Number: 609365-71-1
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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
C₇₆H₄₆N₄O₁₆
Molecular Weight
1271.20
Synonyms
[1,1'-Biphenyl]-3,5-dicarboxylic acid, 4',4''',4''''',4'''''''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis- (9CI)
SMILES
O=C(C1=CC(C2=CC=C(/C3=C(N/4)\C=CC4=C(C5=CC=C(C6=CC(C(O)=O)=CC(C(O)=O)=C6)C=C5)\C(C=C/7)=NC7=C(C8=CC=C(C9=CC(C(O)=O)=CC(C(O)=O)=C9)C=C8)/C(N%10)=CC=C%10/C(C%11=CC=C(C%12=CC(C(O)=O)=CC(C(O)=O)=C%12)C=C%11)=C%13N=C3C=C\%13)C=C2)=CC(C(O)=O)=C1)O
Tpsa
355.76
Logp
15.7916
H Acceptors
10
H Donors
10
Rotatable Bonds
16
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: C₇₆H₄₆N₄O₁₆
Molecular Weight: 1271.20
Synonyms: [1,1'-Biphenyl]-3,5-dicarboxylic acid, 4',4''',4''''',4'''''''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis- (9CI)
SMILES: O=C(C1=CC(C2=CC=C(/C3=C(N/4)\C=CC4=C(C5=CC=C(C6=CC(C(O)=O)=CC(C(O)=O)=C6)C=C5)\C(C=C/7)=NC7=C(C8=CC=C(C9=CC(C(O)=O)=CC(C(O)=O)=C9)C=C8)/C(N%10)=CC=C%10/C(C%11=CC=C(C%12=CC(C(O)=O)=CC(C(O)=O)=C%12)C=C%11)=C%13N=C3C=C\%13)C=C2)=CC(C(O)=O)=C1)O
Tpsa: 355.76
Logp: 15.7916
H Acceptors: 10
H Donors: 10
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇₆H₄₆N₄O₁₆
Molecular Weight:
1271.20
Synonyms:
[1,1'-Biphenyl]-3,5-dicarboxylic acid, 4',4''',4''''',4'''''''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis- (9CI)
SMILES:
O=C(C1=CC(C2=CC=C(/C3=C(N/4)\C=CC4=C(C5=CC=C(C6=CC(C(O)=O)=CC(C(O)=O)=C6)C=C5)\C(C=C/7)=NC7=C(C8=CC=C(C9=CC(C(O)=O)=CC(C(O)=O)=C9)C=C8)/C(N%10)=CC=C%10/C(C%11=CC=C(C%12=CC(C(O)=O)=CC(C(O)=O)=C%12)C=C%11)=C%13N=C3C=C\%13)C=C2)=CC(C(O)=O)=C1)O
Tpsa:
355.76
Logp:
15.7916
H Acceptors:
10
H Donors:
10
Rotatable Bonds:
16
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₁₄N₄O₄
Molecular Weight: 374.35
Synonyms: None
SMILES: O=C(C1=CC=C(N2C=CN=C2C3=NC=CN3C4=CC=C(C(O)=O)C=C4)C=C1)O
Tpsa: 110.24
Logp: 3.1214
H Acceptors: 6
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:
C₂₀H₁₄N₄O₄
Molecular Weight:
374.35
Synonyms:
None
SMILES:
O=C(C1=CC=C(N2C=CN=C2C3=NC=CN3C4=CC=C(C(O)=O)C=C4)C=C1)O
Tpsa:
110.24
Logp:
3.1214
H Acceptors:
6
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: C₃₁H₂₁N₅O
Molecular Weight: 479.53
Synonyms: None
SMILES: OC1=C(C2=CC=NC=C2)C=C(C3=CC(C4=NC=CC=C4)=NC(C5=NC=CC=C5)=C3)C=C1C6=CC=NC=C6
Tpsa: 84.68
Logp: 6.7022
H Acceptors: 6
H Donors: 1
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:
C₃₁H₂₁N₅O
Molecular Weight:
479.53
Synonyms:
None
SMILES:
OC1=C(C2=CC=NC=C2)C=C(C3=CC(C4=NC=CC=C4)=NC(C5=NC=CC=C5)=C3)C=C1C6=CC=NC=C6
Tpsa:
84.68
Logp:
6.7022
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: 4°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇BN₂O₄
Molecular Weight: 181.94
Synonyms: None
SMILES: NC1=NC=C(B(O)O)C=C1C(O)=O
Tpsa: 116.67
Logp: -1.9582
H Acceptors: 5
H Donors: 4
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₇BN₂O₄
Molecular Weight:
181.94
Synonyms:
None
SMILES:
NC1=NC=C(B(O)O)C=C1C(O)=O
Tpsa:
116.67
Logp:
-1.9582
H Acceptors:
5
H Donors:
4
Rotatable Bonds:
2