CS-1167228
1-(3-Fluorophenyl)-3-oxocyclohexane-1-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1956386-18-7
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₃FO₃
Molecular Weight
236.24
Synonyms
None
SMILES
O=C(O)C1(C=2C=CC=C(F)C2)CC(=O)CCC1
Tpsa
54.37
Logp
2.2912
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃FO₃
Molecular Weight: 236.24
Synonyms: None
SMILES: O=C(O)C1(C=2C=CC=C(F)C2)CC(=O)CCC1
Tpsa: 54.37
Logp: 2.2912
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃FO₃
Molecular Weight:
236.24
Synonyms:
None
SMILES:
O=C(O)C1(C=2C=CC=C(F)C2)CC(=O)CCC1
Tpsa:
54.37
Logp:
2.2912
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: C₈H₁₀N₂OS
Molecular Weight: 182.24
Synonyms: None
SMILES: O=C(N)C=1SC(=NC1)C2CCC2
Tpsa: 55.98
Logp: 1.5095
H Acceptors: 3
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:
C₈H₁₀N₂OS
Molecular Weight:
182.24
Synonyms:
None
SMILES:
O=C(N)C=1SC(=NC1)C2CCC2
Tpsa:
55.98
Logp:
1.5095
H Acceptors:
3
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: C₈H₉IN₂O₂
Molecular Weight: 292.08
Synonyms: None
SMILES: O=C(OCC)C=1C=NC=C(I)C1N
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₉IN₂O₂
Molecular Weight:
292.08
Synonyms:
None
SMILES:
O=C(OCC)C=1C=NC=C(I)C1N
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₃ClF₃NO₃S
Molecular Weight: 261.60
Synonyms: None
SMILES: O=S(=O)(Cl)C1=NC=CC(OC(F)F)=C1F
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₃ClF₃NO₃S
Molecular Weight:
261.60
Synonyms:
None
SMILES:
O=S(=O)(Cl)C1=NC=CC(OC(F)F)=C1F
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A