CS-1039962
1-(3-Isobutyl-1-methyl-1H-pyrazol-5-yl)ethan-1-one
Manufacturer: ChemScene
CAS Number: 1897738-31-6
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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
C₁₀H₁₆N₂O
Molecular Weight
180.25
Synonyms
None
SMILES
O=C(C1=CC(=NN1C)CC(C)C)C
Tpsa
34.89
Logp
1.8212
H Acceptors
3
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: C₁₀H₁₆N₂O
Molecular Weight: 180.25
Synonyms: None
SMILES: O=C(C1=CC(=NN1C)CC(C)C)C
Tpsa: 34.89
Logp: 1.8212
H Acceptors: 3
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:
C₁₀H₁₆N₂O
Molecular Weight:
180.25
Synonyms:
None
SMILES:
O=C(C1=CC(=NN1C)CC(C)C)C
Tpsa:
34.89
Logp:
1.8212
H Acceptors:
3
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: C₁₀H₈F₂N₂O
Molecular Weight: 210.18
Synonyms: None
SMILES: FC1=CC=C(C(F)=C1)C(O)C=2C=NNC2
Tpsa: 48.91
Logp: 1.7696
H Acceptors: 2
H Donors: 2
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:
C₁₀H₈F₂N₂O
Molecular Weight:
210.18
Synonyms:
None
SMILES:
FC1=CC=C(C(F)=C1)C(O)C=2C=NNC2
Tpsa:
48.91
Logp:
1.7696
H Acceptors:
2
H Donors:
2
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: C₁₁H₁₂BrNO₂
Molecular Weight: 270.12
Synonyms: None
SMILES: O=C(O)C1(NCCC1)C=2C=CC=C(Br)C2
Tpsa: 49.33
Logp: 2.1124
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₂BrNO₂
Molecular Weight:
270.12
Synonyms:
None
SMILES:
O=C(O)C1(NCCC1)C=2C=CC=C(Br)C2
Tpsa:
49.33
Logp:
2.1124
H Acceptors:
2
H Donors:
2
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: C₁₀H₈BrN₃O
Molecular Weight: 266.09
Synonyms: None
SMILES: BrC1=CC=C(OC2=CN=C(N=C2)N)C=C1
Tpsa: 61.03
Logp: 2.6136
H Acceptors: 4
H Donors: 1
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:
C₁₀H₈BrN₃O
Molecular Weight:
266.09
Synonyms:
None
SMILES:
BrC1=CC=C(OC2=CN=C(N=C2)N)C=C1
Tpsa:
61.03
Logp:
2.6136
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2