CS-0597775
3-Butyl-5,5-dimethylcyclohex-2-en-1-one
Manufacturer: ChemScene
CAS Number: 56745-22-3
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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
C₁₂H₂₀O
Molecular Weight
180.29
Synonyms
None
SMILES
CCCCC1=CC(=O)CC(C1)(C)C
Tpsa
17.07
Logp
3.4921
H Acceptors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₀O
Molecular Weight: 180.29
Synonyms: None
SMILES: CCCCC1=CC(=O)CC(C1)(C)C
Tpsa: 17.07
Logp: 3.4921
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₀O
Molecular Weight:
180.29
Synonyms:
None
SMILES:
CCCCC1=CC(=O)CC(C1)(C)C
Tpsa:
17.07
Logp:
3.4921
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄Cl₂N₆
Molecular Weight: 243.05
Synonyms: None
SMILES: C(C#N)N(CC#N)C1=NC(=NC(=N1)Cl)Cl
Tpsa: 89.49
Logp: 1.03196
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₄Cl₂N₆
Molecular Weight:
243.05
Synonyms:
None
SMILES:
C(C#N)N(CC#N)C1=NC(=NC(=N1)Cl)Cl
Tpsa:
89.49
Logp:
1.03196
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂O₂
Molecular Weight: 188.22
Synonyms: None
SMILES: CCC1=CC=CC2=C1OC(=C2)C(=O)C
Tpsa: 30.21
Logp: 3.1978
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:
C₁₂H₁₂O₂
Molecular Weight:
188.22
Synonyms:
None
SMILES:
CCC1=CC=CC2=C1OC(=C2)C(=O)C
Tpsa:
30.21
Logp:
3.1978
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂ClFO
Molecular Weight: 202.65
Synonyms: None
SMILES: C1=CC(=CC=C1C(CCCCl)O)F
Tpsa: 20.23
Logp: 2.8781
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂ClFO
Molecular Weight:
202.65
Synonyms:
None
SMILES:
C1=CC(=CC=C1C(CCCCl)O)F
Tpsa:
20.23
Logp:
2.8781
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
4