CS-1073647
1-Benzyl-3-(4-cyanophenyl)-1H-pyrazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2761327-75-5
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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
C₁₈H₁₃N₃O₂
Molecular Weight
303.31
Synonyms
None
SMILES
N#CC=1C=CC(=CC1)C2=NN(C(=C2)C(=O)O)CC=3C=CC=CC3
Tpsa
78.91
Logp
3.16828
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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: C₁₈H₁₃N₃O₂
Molecular Weight: 303.31
Synonyms: None
SMILES: N#CC=1C=CC(=CC1)C2=NN(C(=C2)C(=O)O)CC=3C=CC=CC3
Tpsa: 78.91
Logp: 3.16828
H Acceptors: 4
H Donors: 1
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:
C₁₈H₁₃N₃O₂
Molecular Weight:
303.31
Synonyms:
None
SMILES:
N#CC=1C=CC(=CC1)C2=NN(C(=C2)C(=O)O)CC=3C=CC=CC3
Tpsa:
78.91
Logp:
3.16828
H Acceptors:
4
H Donors:
1
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: C₁₁H₂₁NO₂
Molecular Weight: 199.29
Synonyms: None
SMILES: OCCC1NCCC2(CC(OC)C2)C1
Tpsa: 41.49
Logp: 0.916
H Acceptors: 3
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:
C₁₁H₂₁NO₂
Molecular Weight:
199.29
Synonyms:
None
SMILES:
OCCC1NCCC2(CC(OC)C2)C1
Tpsa:
41.49
Logp:
0.916
H Acceptors:
3
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: C₉H₁₁FN₂O₄
Molecular Weight: 230.19
Synonyms: None
SMILES: NC1=C([N+]([O-])=O)C=CC(OCCOC)=C1F
Tpsa: 87.62
Logp: 1.3413
H Acceptors: 5
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:
C₉H₁₁FN₂O₄
Molecular Weight:
230.19
Synonyms:
None
SMILES:
NC1=C([N+]([O-])=O)C=CC(OCCOC)=C1F
Tpsa:
87.62
Logp:
1.3413
H Acceptors:
5
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: C₁₉H₃₁BN₂O₃Si
Molecular Weight: 374.36
Synonyms: None
SMILES: C[Si](CCOCN1C2=CC=CC(B3OC(C)(C)C(C)(C)O3)=C2N=C1)(C)C
Tpsa: 45.51
Logp: 3.6478
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:
C₁₉H₃₁BN₂O₃Si
Molecular Weight:
374.36
Synonyms:
None
SMILES:
C[Si](CCOCN1C2=CC=CC(B3OC(C)(C)C(C)(C)O3)=C2N=C1)(C)C
Tpsa:
45.51
Logp:
3.6478
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
6