CS-0565237
5-(Benzylamino)isophthalic acid
Manufacturer: ChemScene
CAS Number: 1804972-12-0
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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
C₁₅H₁₃NO₄
Molecular Weight
271.27
Synonyms
None
SMILES
O=C(C1=CC(NCC2=CC=CC=C2)=CC(C(O)=O)=C1)O
Tpsa
86.63
Logp
2.6951
H Acceptors
3
H Donors
3
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: C₁₅H₁₃NO₄
Molecular Weight: 271.27
Synonyms: None
SMILES: O=C(C1=CC(NCC2=CC=CC=C2)=CC(C(O)=O)=C1)O
Tpsa: 86.63
Logp: 2.6951
H Acceptors: 3
H Donors: 3
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:
C₁₅H₁₃NO₄
Molecular Weight:
271.27
Synonyms:
None
SMILES:
O=C(C1=CC(NCC2=CC=CC=C2)=CC(C(O)=O)=C1)O
Tpsa:
86.63
Logp:
2.6951
H Acceptors:
3
H Donors:
3
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: C₅₄H₃₂O₈
Molecular Weight: 808.83
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: O=C(C1=CC=C(C2=CC=C3C(C4=C(C5=C3C6=C(C=C(C7=CC=C(C(O)=O)C=C7)C=C6)C8=C5C=CC(C9=CC=C(C(O)=O)C=C9)=C8)C=CC(C%10=CC=C(C(O)=O)C=C%10)=C4)=C2)C=C1)O
Tpsa: 149.2
Logp: 12.9134
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₄H₃₂O₈
Molecular Weight:
808.83
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
O=C(C1=CC=C(C2=CC=C3C(C4=C(C5=C3C6=C(C=C(C7=CC=C(C(O)=O)C=C7)C=C6)C8=C5C=CC(C9=CC=C(C(O)=O)C=C9)=C8)C=CC(C%10=CC=C(C(O)=O)C=C%10)=C4)=C2)C=C1)O
Tpsa:
149.2
Logp:
12.9134
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₁₄F₃NO₄
Molecular Weight: 401.34
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: O=C(C1=CC=C(C2=CC(C(F)(F)F)=CC(C3=CC=C(C(O)=O)C=C3)=C2N)C=C1)O
Tpsa: 100.62
Logp: 5.018
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₁₄F₃NO₄
Molecular Weight:
401.34
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
O=C(C1=CC=C(C2=CC(C(F)(F)F)=CC(C3=CC=C(C(O)=O)C=C3)=C2N)C=C1)O
Tpsa:
100.62
Logp:
5.018
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₄H₂₂F₄O₈
Molecular Weight: 754.63
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: O=C(C1=CC=C(C2=C(C3=C45)C=CC4=C(C6=CC(F)=C(C(O)=O)C=C6)C=C(C7=CC(F)=C(C(O)=O)C=C7)C5=CC=C3C(C8=CC=C(C(F)=C8)C(O)=O)=C2)C=C1F)O
Tpsa: 149.2
Logp: 10.6012
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₄H₂₂F₄O₈
Molecular Weight:
754.63
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
O=C(C1=CC=C(C2=C(C3=C45)C=CC4=C(C6=CC(F)=C(C(O)=O)C=C6)C=C(C7=CC(F)=C(C(O)=O)C=C7)C5=CC=C3C(C8=CC=C(C(F)=C8)C(O)=O)=C2)C=C1F)O
Tpsa:
149.2
Logp:
10.6012
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
8