CS-0825967
2-(4-Chloro-2-fluorophenyl)-4-(difluoromethyl)-5-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Manufacturer: ChemScene
CAS Number: 111992-05-3
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₀H₇ClF₃N₃O
Molecular Weight
277.63
Synonyms
None
SMILES
ClC1=CC=C(N2N=C(C)N(C(F)F)C2=O)C(F)=C1
Tpsa
39.82
Logp
2.53002
H Acceptors
4
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 111992-05-3 | 1-(4-Cl-2-fluorophenyl)-4-difluoromethyl-4,5-dihydro-3-methyl-1H-1,2,4-triazol-5-(1H)one | A2B Chem | -- |
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇ClF₃N₃O
Molecular Weight: 277.63
Synonyms: None
SMILES: ClC1=CC=C(N2N=C(C)N(C(F)F)C2=O)C(F)=C1
Tpsa: 39.82
Logp: 2.53002
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇ClF₃N₃O
Molecular Weight:
277.63
Synonyms:
None
SMILES:
ClC1=CC=C(N2N=C(C)N(C(F)F)C2=O)C(F)=C1
Tpsa:
39.82
Logp:
2.53002
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: -20°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₀O₆
Molecular Weight: 178.14
Synonyms: None
SMILES: O=C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C=O
Tpsa: 115.06
Logp: -3.1722
H Acceptors: 6
H Donors: 4
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
-20°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₀O₆
Molecular Weight:
178.14
Synonyms:
None
SMILES:
O=C[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C=O
Tpsa:
115.06
Logp:
-3.1722
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂O₂
Molecular Weight: 164.20
Synonyms: None
SMILES: O=C(CC)C1=CC=C(CO)C=C1
Tpsa: 37.3
Logp: 1.7716
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂O₂
Molecular Weight:
164.20
Synonyms:
None
SMILES:
O=C(CC)C1=CC=C(CO)C=C1
Tpsa:
37.3
Logp:
1.7716
H Acceptors:
2
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: C₇H₁₀O₃
Molecular Weight: 142.15
Synonyms: None
SMILES: CCC(O)C#CC(OC)=O
Tpsa: 46.53
Logp: -0.0663
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀O₃
Molecular Weight:
142.15
Synonyms:
None
SMILES:
CCC(O)C#CC(OC)=O
Tpsa:
46.53
Logp:
-0.0663
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1