CS-1025399
1-(1-Methyl-1H-pyrazol-3-yl)butane-1,3-dione
Manufacturer: ChemScene
CAS Number: 1699587-06-8
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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
C₈H₁₀N₂O₂
Molecular Weight
166.18
Synonyms
None
SMILES
O=C(C1=NN(C=C1)C)CC(=O)C
Tpsa
51.96
Logp
0.5819
H Acceptors
4
H Donors
0
Rotatable Bonds
3
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: C₈H₁₀N₂O₂
Molecular Weight: 166.18
Synonyms: None
SMILES: O=C(C1=NN(C=C1)C)CC(=O)C
Tpsa: 51.96
Logp: 0.5819
H Acceptors: 4
H Donors: 0
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:
C₈H₁₀N₂O₂
Molecular Weight:
166.18
Synonyms:
None
SMILES:
O=C(C1=NN(C=C1)C)CC(=O)C
Tpsa:
51.96
Logp:
0.5819
H Acceptors:
4
H Donors:
0
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: C₁₂H₁₄N₂O₂
Molecular Weight: 218.25
Synonyms: None
SMILES: O=N(=O)C1=CC=CC2=C1NCC23CCCC3
Tpsa: 55.17
Logp: 2.8321
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₄N₂O₂
Molecular Weight:
218.25
Synonyms:
None
SMILES:
O=N(=O)C1=CC=CC2=C1NCC23CCCC3
Tpsa:
55.17
Logp:
2.8321
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉BrFN
Molecular Weight: 230.08
Synonyms: None
SMILES: FC=1C=C(C=2NCCC2C1Br)C
Tpsa: 12.03
Logp: 2.86462
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉BrFN
Molecular Weight:
230.08
Synonyms:
None
SMILES:
FC=1C=C(C=2NCCC2C1Br)C
Tpsa:
12.03
Logp:
2.86462
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁F₃N₂O
Molecular Weight: 196.17
Synonyms: None
SMILES: O=C(NC1(C)CNCC1)C(F)(F)F
Tpsa: 41.13
Logp: 0.4169
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁F₃N₂O
Molecular Weight:
196.17
Synonyms:
None
SMILES:
O=C(NC1(C)CNCC1)C(F)(F)F
Tpsa:
41.13
Logp:
0.4169
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1