CS-0094733
Methyl 4-fluoro-1-methyl-1H-pyrazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 2112898-55-0
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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
C₆H₇FN₂O₂
Molecular Weight
158.13
Synonyms
None
SMILES
O=C(C1=C(F)C=NN1C)OC
Tpsa
44.12
Logp
0.3458
H Acceptors
4
H Donors
0
Rotatable Bonds
1
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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: C₆H₇FN₂O₂
Molecular Weight: 158.13
Synonyms: None
SMILES: O=C(C1=C(F)C=NN1C)OC
Tpsa: 44.12
Logp: 0.3458
H Acceptors: 4
H Donors: 0
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:
C₆H₇FN₂O₂
Molecular Weight:
158.13
Synonyms:
None
SMILES:
O=C(C1=C(F)C=NN1C)OC
Tpsa:
44.12
Logp:
0.3458
H Acceptors:
4
H Donors:
0
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: C₅H₉NO₃
Molecular Weight: 131.13
Synonyms: None
SMILES: O=C1O[C@@H](C)[C@@H](CO)N1
Tpsa: 58.56
Logp: -0.5244
H Acceptors: 3
H Donors: 2
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:
C₅H₉NO₃
Molecular Weight:
131.13
Synonyms:
None
SMILES:
O=C1O[C@@H](C)[C@@H](CO)N1
Tpsa:
58.56
Logp:
-0.5244
H Acceptors:
3
H Donors:
2
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: C₅H₅N₃O₃
Molecular Weight: 155.11
Synonyms: None
SMILES: O=CC1=NN(C)C=C1[N+]([O-])=O
Tpsa: 78.03
Logp: 0.1408
H Acceptors: 5
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:
C₅H₅N₃O₃
Molecular Weight:
155.11
Synonyms:
None
SMILES:
O=CC1=NN(C)C=C1[N+]([O-])=O
Tpsa:
78.03
Logp:
0.1408
H Acceptors:
5
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: C₆H₉NO
Molecular Weight: 111.14
Synonyms: 2,2-dimethylpent-4-ynamide
SMILES: C#CC(C)(C)C(N)=O
Tpsa: 43.09
Logp: 0.1311
H Acceptors: 1
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:
C₆H₉NO
Molecular Weight:
111.14
Synonyms:
2,2-dimethylpent-4-ynamide
SMILES:
C#CC(C)(C)C(N)=O
Tpsa:
43.09
Logp:
0.1311
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1