CS-1025803
1-(1-Methyl-1H-pyrazol-5-yl)butane-1,3-dione
Manufacturer: ChemScene
CAS Number: 1701684-26-5
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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=CC=NN1C)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=CC=NN1C)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=CC=NN1C)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: C₈H₁₃N₅
Molecular Weight: 179.22
Synonyms: None
SMILES: N1=CNN2C1=NCC3CNCCC23
Tpsa: 52.02
Logp: -0.8174
H Acceptors: 5
H Donors: 2
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:
C₈H₁₃N₅
Molecular Weight:
179.22
Synonyms:
None
SMILES:
N1=CNN2C1=NCC3CNCCC23
Tpsa:
52.02
Logp:
-0.8174
H Acceptors:
5
H Donors:
2
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: C₉H₁₇BrO
Molecular Weight: 221.13
Synonyms: None
SMILES: BrCC(C)CC1OC(C)CC1
Tpsa: 9.23
Logp: 2.975
H Acceptors: 1
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:
C₉H₁₇BrO
Molecular Weight:
221.13
Synonyms:
None
SMILES:
BrCC(C)CC1OC(C)CC1
Tpsa:
9.23
Logp:
2.975
H Acceptors:
1
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: C₇H₁₂N₄O
Molecular Weight: 168.20
Synonyms: None
SMILES: N1=NN(C=C1COC2CNC2)C
Tpsa: 51.97
Logp: -0.6965
H Acceptors: 5
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:
C₇H₁₂N₄O
Molecular Weight:
168.20
Synonyms:
None
SMILES:
N1=NN(C=C1COC2CNC2)C
Tpsa:
51.97
Logp:
-0.6965
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3