CS-1065505
3-(1-(Difluoromethyl)-3-methyl-1H-pyrazol-4-yl)propiolic acid
Manufacturer: ChemScene
CAS Number: 2625850-21-5
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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
C₈H₆F₂N₂O₂
Molecular Weight
200.14
Synonyms
None
SMILES
O=C(O)C#CC1=CN(N=C1C)C(F)F
Tpsa
55.12
Logp
1.02272
H Acceptors
3
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
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: C₈H₆F₂N₂O₂
Molecular Weight: 200.14
Synonyms: None
SMILES: O=C(O)C#CC1=CN(N=C1C)C(F)F
Tpsa: 55.12
Logp: 1.02272
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:
C₈H₆F₂N₂O₂
Molecular Weight:
200.14
Synonyms:
None
SMILES:
O=C(O)C#CC1=CN(N=C1C)C(F)F
Tpsa:
55.12
Logp:
1.02272
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: C₈H₅BrO₄
Molecular Weight: 245.03
Synonyms: None
SMILES: O=C(O)C=1OC(C#CCO)=C(Br)C1
Tpsa: 70.67
Logp: 1.0841
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:
C₈H₅BrO₄
Molecular Weight:
245.03
Synonyms:
None
SMILES:
O=C(O)C=1OC(C#CCO)=C(Br)C1
Tpsa:
70.67
Logp:
1.0841
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: C₁₃H₉ClO₃
Molecular Weight: 248.66
Synonyms: None
SMILES: O=C(O)C1=CC=2C=C(Cl)C=C(C#CC)C2OC1
Tpsa: 46.53
Logp: 2.5718
H Acceptors: 2
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:
C₁₃H₉ClO₃
Molecular Weight:
248.66
Synonyms:
None
SMILES:
O=C(O)C1=CC=2C=C(Cl)C=C(C#CC)C2OC1
Tpsa:
46.53
Logp:
2.5718
H Acceptors:
2
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: C₁₀H₈ClN₃O₃
Molecular Weight: 253.64
Synonyms: None
SMILES: O=C(N)C=1NC2=C(C(Cl)=CC=C2N(=O)=O)C1C
Tpsa: 102.02
Logp: 2.13682
H Acceptors: 3
H Donors: 2
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:
C₁₀H₈ClN₃O₃
Molecular Weight:
253.64
Synonyms:
None
SMILES:
O=C(N)C=1NC2=C(C(Cl)=CC=C2N(=O)=O)C1C
Tpsa:
102.02
Logp:
2.13682
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2