CS-0882020
4-Fluoro-5-(methoxycarbonyl)-2-methylbenzoic acid
Manufacturer: ChemScene
CAS Number: 2092119-78-1
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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
C₁₀H₉FO₄
Molecular Weight
212.17
Synonyms
None
SMILES
O=C(C1=C(C)C=C(F)C(C(OC)=O)=C1)O
Tpsa
63.6
Logp
1.61892
H Acceptors
3
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₁₀H₉FO₄
Molecular Weight: 212.17
Synonyms: None
SMILES: O=C(C1=C(C)C=C(F)C(C(OC)=O)=C1)O
Tpsa: 63.6
Logp: 1.61892
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:
C₁₀H₉FO₄
Molecular Weight:
212.17
Synonyms:
None
SMILES:
O=C(C1=C(C)C=C(F)C(C(OC)=O)=C1)O
Tpsa:
63.6
Logp:
1.61892
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: C₈H₅ClFN
Molecular Weight: 169.58
Synonyms: None
SMILES: N#CC1=CC(C)=C(F)C(Cl)=C1
Tpsa: 23.79
Logp: 2.6592
H Acceptors: 1
H Donors: 0
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:
C₈H₅ClFN
Molecular Weight:
169.58
Synonyms:
None
SMILES:
N#CC1=CC(C)=C(F)C(Cl)=C1
Tpsa:
23.79
Logp:
2.6592
H Acceptors:
1
H Donors:
0
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: C₈H₁₃BrO₂
Molecular Weight: 221.09
Synonyms: None
SMILES: O=C(C1(CBr)CCCC1)OC
Tpsa: 26.3
Logp: 2.1147
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:
C₈H₁₃BrO₂
Molecular Weight:
221.09
Synonyms:
None
SMILES:
O=C(C1(CBr)CCCC1)OC
Tpsa:
26.3
Logp:
2.1147
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: C₁₀H₁₀Cl₂N₂
Molecular Weight: 229.11
Synonyms: None
SMILES: ClC1=NN=C(Cl)C(C2CC2)=C1C3CC3
Tpsa: 25.78
Logp: 3.5382
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:
C₁₀H₁₀Cl₂N₂
Molecular Weight:
229.11
Synonyms:
None
SMILES:
ClC1=NN=C(Cl)C(C2CC2)=C1C3CC3
Tpsa:
25.78
Logp:
3.5382
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2