CS-0498244
4-(Benzyloxy)-3-(5,5-dimethyl-1,3-dioxan-2-yl)-5-fluorobenzoic acid
Manufacturer: ChemScene
CAS Number: 2766130-42-9
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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
C₂₀H₂₁FO₅
Molecular Weight
360.38
Synonyms
None
SMILES
O=C(O)C1=CC(F)=C(OCC2=CC=CC=C2)C(C3OCC(C)(C)CO3)=C1
Tpsa
64.99
Logp
4.1745
H Acceptors
4
H Donors
1
Rotatable Bonds
5
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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: C₂₀H₂₁FO₅
Molecular Weight: 360.38
Synonyms: None
SMILES: O=C(O)C1=CC(F)=C(OCC2=CC=CC=C2)C(C3OCC(C)(C)CO3)=C1
Tpsa: 64.99
Logp: 4.1745
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₁FO₅
Molecular Weight:
360.38
Synonyms:
None
SMILES:
O=C(O)C1=CC(F)=C(OCC2=CC=CC=C2)C(C3OCC(C)(C)CO3)=C1
Tpsa:
64.99
Logp:
4.1745
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₅NO
Molecular Weight: 153.22
Synonyms: 4(1H)-Quinolinone, octahydro-, cis-
SMILES: O=C1CCN[C@]2([H])CCCC[C@]12[H]
Tpsa: 29.1
Logp: 1.1076
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₅NO
Molecular Weight:
153.22
Synonyms:
4(1H)-Quinolinone, octahydro-, cis-
SMILES:
O=C1CCN[C@]2([H])CCCC[C@]12[H]
Tpsa:
29.1
Logp:
1.1076
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₆ClNO₂
Molecular Weight: 195.60
Synonyms: None
SMILES: O=C(C1=CN2C=C(Cl)C=CC2=C1)O
Tpsa: 41.71
Logp: 2.2909
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₆ClNO₂
Molecular Weight:
195.60
Synonyms:
None
SMILES:
O=C(C1=CN2C=C(Cl)C=CC2=C1)O
Tpsa:
41.71
Logp:
2.2909
H Acceptors:
2
H Donors:
1
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: C₁₀H₆BrClO
Molecular Weight: 257.51
Synonyms: None
SMILES: OC1=CC(Cl)=C2C(Br)=CC=CC2=C1
Tpsa: 20.23
Logp: 3.9613
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆BrClO
Molecular Weight:
257.51
Synonyms:
None
SMILES:
OC1=CC(Cl)=C2C(Br)=CC=CC2=C1
Tpsa:
20.23
Logp:
3.9613
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0