CS-0170215
4'-((3,5-Dicarboxyphenyl)carbamoyl)-[1,1'-biphenyl]-3,5-dicarboxylic acid
Manufacturer: ChemScene
CAS Number: 2380036-45-1
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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
C₂₃H₁₅NO₉
Molecular Weight
449.37
Synonyms
None
SMILES
O=C(C1=CC(C(O)=O)=CC(C2=CC=C(C(NC3=CC(C(O)=O)=CC(C(O)=O)=C3)=O)C=C2)=C1)O
Tpsa
178.3
Logp
3.3987
H Acceptors
5
H Donors
5
Rotatable Bonds
7
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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: C₂₃H₁₅NO₉
Molecular Weight: 449.37
Synonyms: None
SMILES: O=C(C1=CC(C(O)=O)=CC(C2=CC=C(C(NC3=CC(C(O)=O)=CC(C(O)=O)=C3)=O)C=C2)=C1)O
Tpsa: 178.3
Logp: 3.3987
H Acceptors: 5
H Donors: 5
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:
C₂₃H₁₅NO₉
Molecular Weight:
449.37
Synonyms:
None
SMILES:
O=C(C1=CC(C(O)=O)=CC(C2=CC=C(C(NC3=CC(C(O)=O)=CC(C(O)=O)=C3)=O)C=C2)=C1)O
Tpsa:
178.3
Logp:
3.3987
H Acceptors:
5
H Donors:
5
Rotatable Bonds:
7
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈N₄
Molecular Weight: 184.20
Synonyms: Letrozole Intermediate
SMILES: C1=C(C=CC(=C1)CN2C=NC=N2)C#N
Tpsa: 54.5
Logp: 1.19808
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈N₄
Molecular Weight:
184.20
Synonyms:
Letrozole Intermediate
SMILES:
C1=C(C=CC(=C1)CN2C=NC=N2)C#N
Tpsa:
54.5
Logp:
1.19808
H Acceptors:
4
H Donors:
0
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: C₁₅H₁₀O₇
Molecular Weight: 302.24
Synonyms: 4-(3,5-Dicarboxyphenyl)-2-hydroxybenzoic acid
SMILES: O=C(C1=CC(C(O)=O)=CC(C2=CC=C(C(O)=O)C(O)=C2)=C1)O
Tpsa: 132.13
Logp: 2.1538
H Acceptors: 4
H Donors: 4
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:
C₁₅H₁₀O₇
Molecular Weight:
302.24
Synonyms:
4-(3,5-Dicarboxyphenyl)-2-hydroxybenzoic acid
SMILES:
O=C(C1=CC(C(O)=O)=CC(C2=CC=C(C(O)=O)C(O)=C2)=C1)O
Tpsa:
132.13
Logp:
2.1538
H Acceptors:
4
H Donors:
4
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: C₁₄H₉FO₄
Molecular Weight: 260.22
Synonyms: 4-(4-Carboxy-3-fluorophenyl)benzoic acid
SMILES: O=C(C1=CC=C(C2=CC=C(C(O)=O)C=C2)C=C1F)O
Tpsa: 74.6
Logp: 2.8891
H Acceptors: 2
H Donors: 2
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:
C₁₄H₉FO₄
Molecular Weight:
260.22
Synonyms:
4-(4-Carboxy-3-fluorophenyl)benzoic acid
SMILES:
O=C(C1=CC=C(C2=CC=C(C(O)=O)C=C2)C=C1F)O
Tpsa:
74.6
Logp:
2.8891
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3