CS-0881211
3-Cyano-1,4-dimethyl-1H-pyrazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2092105-21-8
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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
C₇H₇N₃O₂
Molecular Weight
165.15
Synonyms
None
SMILES
O=C(C1=C(C)C(C#N)=NN1C)O
Tpsa
78.91
Logp
0.2984
H Acceptors
4
H Donors
1
Rotatable Bonds
1
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: C₇H₇N₃O₂
Molecular Weight: 165.15
Synonyms: None
SMILES: O=C(C1=C(C)C(C#N)=NN1C)O
Tpsa: 78.91
Logp: 0.2984
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:
C₇H₇N₃O₂
Molecular Weight:
165.15
Synonyms:
None
SMILES:
O=C(C1=C(C)C(C#N)=NN1C)O
Tpsa:
78.91
Logp:
0.2984
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: C₉H₇ClN₂O₂
Molecular Weight: 210.62
Synonyms: None
SMILES: O=C(C1=NC(C)=C(C#N)C(C)=C1Cl)O
Tpsa: 73.98
Logp: 1.92172
H Acceptors: 3
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:
C₉H₇ClN₂O₂
Molecular Weight:
210.62
Synonyms:
None
SMILES:
O=C(C1=NC(C)=C(C#N)C(C)=C1Cl)O
Tpsa:
73.98
Logp:
1.92172
H Acceptors:
3
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: C₈H₈FIO₂
Molecular Weight: 282.05
Synonyms: None
SMILES: OCC1=C(I)C=CC(OC)=C1F
Tpsa: 29.46
Logp: 1.9312
H Acceptors: 2
H Donors: 1
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:
C₈H₈FIO₂
Molecular Weight:
282.05
Synonyms:
None
SMILES:
OCC1=C(I)C=CC(OC)=C1F
Tpsa:
29.46
Logp:
1.9312
H Acceptors:
2
H Donors:
1
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: C₉H₉ClN₂O
Molecular Weight: 196.63
Synonyms: None
SMILES: N#CC1=C(C)C(Cl)=C(CO)N=C1C
Tpsa: 56.91
Logp: 1.71582
H Acceptors: 3
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:
C₉H₉ClN₂O
Molecular Weight:
196.63
Synonyms:
None
SMILES:
N#CC1=C(C)C(Cl)=C(CO)N=C1C
Tpsa:
56.91
Logp:
1.71582
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1