CS-0645675
1-(1-Methoxy-2-methyl-1-oxopropan-2-yl)-1H-pyrazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2468054-15-9
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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
C₉H₁₂N₂O₄
Molecular Weight
212.20
Synonyms
None
SMILES
O=C(C1=NN(C(C)(C)C(OC)=O)C=C1)O
Tpsa
81.42
Logp
0.4894
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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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: C₉H₁₂N₂O₄
Molecular Weight: 212.20
Synonyms: None
SMILES: O=C(C1=NN(C(C)(C)C(OC)=O)C=C1)O
Tpsa: 81.42
Logp: 0.4894
H Acceptors: 5
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:
C₉H₁₂N₂O₄
Molecular Weight:
212.20
Synonyms:
None
SMILES:
O=C(C1=NN(C(C)(C)C(OC)=O)C=C1)O
Tpsa:
81.42
Logp:
0.4894
H Acceptors:
5
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: C₁₂H₁₄ClN₃O
Molecular Weight: 251.71
Synonyms: None
SMILES: NC1=C(Cl)C2=C(N(C3CCCCO3)N=C2)C=C1
Tpsa: 53.07
Logp: 2.971
H Acceptors: 4
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:
C₁₂H₁₄ClN₃O
Molecular Weight:
251.71
Synonyms:
None
SMILES:
NC1=C(Cl)C2=C(N(C3CCCCO3)N=C2)C=C1
Tpsa:
53.07
Logp:
2.971
H Acceptors:
4
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: C₇H₁₀
Molecular Weight: 94.15
Synonyms: None
SMILES: CC1(C#C)CCC1
Tpsa: 0
Logp: 1.8098
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀
Molecular Weight:
94.15
Synonyms:
None
SMILES:
CC1(C#C)CCC1
Tpsa:
0
Logp:
1.8098
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₀F₂N₂
Molecular Weight: 136.14
Synonyms: None
SMILES: NC1C(F)(F)CNCC1
Tpsa: 38.05
Logp: -0.0577
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₀F₂N₂
Molecular Weight:
136.14
Synonyms:
None
SMILES:
NC1C(F)(F)CNCC1
Tpsa:
38.05
Logp:
-0.0577
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0