CS-0611401
4-Fluoro-4-isopropylcyclohexan-1-one
Manufacturer: ChemScene
CAS Number: 2561552-65-4
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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
C₉H₁₅FO
Molecular Weight
158.21
Synonyms
None
SMILES
O=C1CCC(C(C)C)(F)CC1
Tpsa
17.07
Logp
2.4938
H Acceptors
1
H Donors
0
Rotatable Bonds
1
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: C₉H₁₅FO
Molecular Weight: 158.21
Synonyms: None
SMILES: O=C1CCC(C(C)C)(F)CC1
Tpsa: 17.07
Logp: 2.4938
H Acceptors: 1
H Donors: 0
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:
C₉H₁₅FO
Molecular Weight:
158.21
Synonyms:
None
SMILES:
O=C1CCC(C(C)C)(F)CC1
Tpsa:
17.07
Logp:
2.4938
H Acceptors:
1
H Donors:
0
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: C₁₁H₁₉NO₄
Molecular Weight: 229.27
Synonyms: None
SMILES: COC([C@H]1[C@@H](CN1C(OC(C)(C)C)=O)C)=O
Tpsa: 55.84
Logp: 1.4148
H Acceptors: 4
H Donors: 0
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:
C₁₁H₁₉NO₄
Molecular Weight:
229.27
Synonyms:
None
SMILES:
COC([C@H]1[C@@H](CN1C(OC(C)(C)C)=O)C)=O
Tpsa:
55.84
Logp:
1.4148
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₃NO₂
Molecular Weight: 191.23
Synonyms: 1H-Pyrrole-2-carboxylic acid,4-ethynyl-3,5-dimethyl-,ethyl ester
SMILES: O=C(C1=C(C)C(C#C)=C(C)N1)OCC
Tpsa: 42.09
Logp: 1.78954
H Acceptors: 2
H Donors: 1
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:
C₁₁H₁₃NO₂
Molecular Weight:
191.23
Synonyms:
1H-Pyrrole-2-carboxylic acid,4-ethynyl-3,5-dimethyl-,ethyl ester
SMILES:
O=C(C1=C(C)C(C#C)=C(C)N1)OCC
Tpsa:
42.09
Logp:
1.78954
H Acceptors:
2
H Donors:
1
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: C₇H₆N₂S
Molecular Weight: 150.20
Synonyms: Pyrimidine, 4-ethynyl-2-(methylthio)- (9CI)
SMILES: CSC1=NC=CC(C#C)=N1
Tpsa: 25.78
Logp: 1.1798
H Acceptors: 3
H Donors: 0
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:
C₇H₆N₂S
Molecular Weight:
150.20
Synonyms:
Pyrimidine, 4-ethynyl-2-(methylthio)- (9CI)
SMILES:
CSC1=NC=CC(C#C)=N1
Tpsa:
25.78
Logp:
1.1798
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1