CS-0756825
1-(4-Methoxybenzyl)-3-(trifluoromethyl)-4-vinyl-1h-pyrazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1956335-92-4
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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
C₁₅H₁₃F₃N₂O₃
Molecular Weight
326.27
Synonyms
None
SMILES
COC1=CC=C(CN2N=C(C(C=C)=C2C(O)=O)C(F)(F)F)C=C1
Tpsa
64.35
Logp
3.3
H Acceptors
4
H Donors
1
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: C₁₅H₁₃F₃N₂O₃
Molecular Weight: 326.27
Synonyms: None
SMILES: COC1=CC=C(CN2N=C(C(C=C)=C2C(O)=O)C(F)(F)F)C=C1
Tpsa: 64.35
Logp: 3.3
H Acceptors: 4
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:
C₁₅H₁₃F₃N₂O₃
Molecular Weight:
326.27
Synonyms:
None
SMILES:
COC1=CC=C(CN2N=C(C(C=C)=C2C(O)=O)C(F)(F)F)C=C1
Tpsa:
64.35
Logp:
3.3
H Acceptors:
4
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: C₁₃H₁₇N₃O
Molecular Weight: 231.29
Synonyms: None
SMILES: O=C1NC2CNCCC2N1CC1=CC=CC=C1
Tpsa: 44.37
Logp: 0.9423
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₇N₃O
Molecular Weight:
231.29
Synonyms:
None
SMILES:
O=C1NC2CNCCC2N1CC1=CC=CC=C1
Tpsa:
44.37
Logp:
0.9423
H Acceptors:
2
H Donors:
2
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: C₉H₁₂ClN₃O₂
Molecular Weight: 229.66
Synonyms: None
SMILES: Cl.NCC1=C(C=C(C=C1)C(N)=N)C(O)=O
Tpsa: 113.19
Logp: 0.54937
H Acceptors: 3
H Donors: 4
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:
C₉H₁₂ClN₃O₂
Molecular Weight:
229.66
Synonyms:
None
SMILES:
Cl.NCC1=C(C=C(C=C1)C(N)=N)C(O)=O
Tpsa:
113.19
Logp:
0.54937
H Acceptors:
3
H Donors:
4
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: C₁₆H₁₃F₃N₄O₂
Molecular Weight: 350.30
Synonyms: None
SMILES: COC1=CC=C(CN2N=C(C(C=C)=C2C(=O)[CH-][N+]#N)C(F)(F)F)C=C1
Tpsa: 72.27
Logp: 3.79937
H Acceptors: 5
H Donors: 0
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:
C₁₆H₁₃F₃N₄O₂
Molecular Weight:
350.30
Synonyms:
None
SMILES:
COC1=CC=C(CN2N=C(C(C=C)=C2C(=O)[CH-][N+]#N)C(F)(F)F)C=C1
Tpsa:
72.27
Logp:
3.79937
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
6