CS-1137808
1-(4-Chlorobenzyl)-5-methyl-1H-pyrazole-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1344045-71-1
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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
C₁₂H₁₁ClN₂O₂
Molecular Weight
250.68
Synonyms
None
SMILES
O=C(O)C=1C=NN(C1C)CC2=CC=C(Cl)C=C2
Tpsa
55.12
Logp
2.59142
H Acceptors
3
H Donors
1
Rotatable Bonds
3
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
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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: C₁₂H₁₁ClN₂O₂
Molecular Weight: 250.68
Synonyms: None
SMILES: O=C(O)C=1C=NN(C1C)CC2=CC=C(Cl)C=C2
Tpsa: 55.12
Logp: 2.59142
H Acceptors: 3
H Donors: 1
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:
C₁₂H₁₁ClN₂O₂
Molecular Weight:
250.68
Synonyms:
None
SMILES:
O=C(O)C=1C=NN(C1C)CC2=CC=C(Cl)C=C2
Tpsa:
55.12
Logp:
2.59142
H Acceptors:
3
H Donors:
1
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: C₁₀H₁₁FN₂O
Molecular Weight: 194.21
Synonyms: None
SMILES: O=C(C=1C=CC=CC1F)N2CC(N)C2
Tpsa: 46.33
Logp: 0.6088
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁FN₂O
Molecular Weight:
194.21
Synonyms:
None
SMILES:
O=C(C=1C=CC=CC1F)N2CC(N)C2
Tpsa:
46.33
Logp:
0.6088
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂FN₃O₃
Molecular Weight: 265.24
Synonyms: None
SMILES: O=C(O)C=1N=NN(C2=CC(=CC=C2F)C)C1COC
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂FN₃O₃
Molecular Weight:
265.24
Synonyms:
None
SMILES:
O=C(O)C=1N=NN(C2=CC(=CC=C2F)C)C1COC
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁ClINO
Molecular Weight: 311.55
Synonyms: None
SMILES: ClC1=CC=C(I)C(=C1)C(N)COC
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₁ClINO
Molecular Weight:
311.55
Synonyms:
None
SMILES:
ClC1=CC=C(I)C(=C1)C(N)COC
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A