CS-0770123
4-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-oxobutanoic acid
Manufacturer: ChemScene
CAS Number: 491831-88-0
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₁₂N₂O₃
Molecular Weight
196.20
Synonyms
None
SMILES
CC1=NN(C(=O)CCC(O)=O)C(C)=C1
Tpsa
72.19
Logp
1.00494
H Acceptors
4
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 491831-88-0 | 1H-Pyrazole-1-butanoicacid,3,5-dimethyl-gamma-oxo-(9CI) | A2B Chem | -- |
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂N₂O₃
Molecular Weight: 196.20
Synonyms: None
SMILES: CC1=NN(C(=O)CCC(O)=O)C(C)=C1
Tpsa: 72.19
Logp: 1.00494
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂N₂O₃
Molecular Weight:
196.20
Synonyms:
None
SMILES:
CC1=NN(C(=O)CCC(O)=O)C(C)=C1
Tpsa:
72.19
Logp:
1.00494
H Acceptors:
4
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: C₇H₈N₂O₃
Molecular Weight: 168.15
Synonyms: None
SMILES: OC(C[N+]([O-])=O)C1=CN=CC=C1
Tpsa: 76.26
Logp: 0.3917
H Acceptors: 4
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:
C₇H₈N₂O₃
Molecular Weight:
168.15
Synonyms:
None
SMILES:
OC(C[N+]([O-])=O)C1=CN=CC=C1
Tpsa:
76.26
Logp:
0.3917
H Acceptors:
4
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: C₅H₅ClF₂N₂O₂S
Molecular Weight: 230.62
Synonyms: None
SMILES: CN1N=C(C=C1S(Cl)(=O)=O)C(F)F
Tpsa: 51.96
Logp: 1.2852
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:
C₅H₅ClF₂N₂O₂S
Molecular Weight:
230.62
Synonyms:
None
SMILES:
CN1N=C(C=C1S(Cl)(=O)=O)C(F)F
Tpsa:
51.96
Logp:
1.2852
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₃FO₃
Molecular Weight: 260.26
Synonyms: None
SMILES: OC(=O)CC1=CC=C(OCC2=CC=C(F)C=C2)C=C1
Tpsa: 46.53
Logp: 3.0318
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₃FO₃
Molecular Weight:
260.26
Synonyms:
None
SMILES:
OC(=O)CC1=CC=C(OCC2=CC=C(F)C=C2)C=C1
Tpsa:
46.53
Logp:
3.0318
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5