CS-0593475
5-Methyl-4-(prop-2-yn-1-yl)-2-(2,4,6-trichlorophenyl)-2,4-dihydro-3H-pyrazol-3-one
Manufacturer: ChemScene
CAS Number: 400083-44-5
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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
C₁₃H₉Cl₃N₂O
Molecular Weight
315.58
Synonyms
None
SMILES
CC1=NN(C(=O)C1CC#C)C2=C(C=C(C=C2Cl)Cl)Cl
Tpsa
32.67
Logp
4.0088
H Acceptors
2
H Donors
0
Rotatable Bonds
2
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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: C₁₃H₉Cl₃N₂O
Molecular Weight: 315.58
Synonyms: None
SMILES: CC1=NN(C(=O)C1CC#C)C2=C(C=C(C=C2Cl)Cl)Cl
Tpsa: 32.67
Logp: 4.0088
H Acceptors: 2
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:
C₁₃H₉Cl₃N₂O
Molecular Weight:
315.58
Synonyms:
None
SMILES:
CC1=NN(C(=O)C1CC#C)C2=C(C=C(C=C2Cl)Cl)Cl
Tpsa:
32.67
Logp:
4.0088
H Acceptors:
2
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: C₂₁H₁₈O
Molecular Weight: 286.37
Synonyms: None
SMILES: CC1=C2CCCC2=C(C=C1)C(=O)C3=CC=CC4=CC=CC=C43
Tpsa: 17.07
Logp: 4.86792
H Acceptors: 1
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:
C₂₁H₁₈O
Molecular Weight:
286.37
Synonyms:
None
SMILES:
CC1=C2CCCC2=C(C=C1)C(=O)C3=CC=CC4=CC=CC=C43
Tpsa:
17.07
Logp:
4.86792
H Acceptors:
1
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: C11H10BrCl3N2OS
Molecular Weight: 404.54
Synonyms: None
SMILES: CC1=NC(=CS1)C2=CN(C(=C2)C(=O)C(Cl)(Cl)Cl)C.Br
Tpsa: 34.89
Logp: 4.58782
H Acceptors: 4
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:
C11H10BrCl3N2OS
Molecular Weight:
404.54
Synonyms:
None
SMILES:
CC1=NC(=CS1)C2=CN(C(=C2)C(=O)C(Cl)(Cl)Cl)C.Br
Tpsa:
34.89
Logp:
4.58782
H Acceptors:
4
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: C₁₁H₇F₃N₂OS
Molecular Weight: 272.25
Synonyms: None
SMILES: C1=CC=C(C=C1)N2C(=O)C=C(NC2=S)C(F)(F)F
Tpsa: 37.79
Logp: 2.91389
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:
C₁₁H₇F₃N₂OS
Molecular Weight:
272.25
Synonyms:
None
SMILES:
C1=CC=C(C=C1)N2C(=O)C=C(NC2=S)C(F)(F)F
Tpsa:
37.79
Logp:
2.91389
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1