CS-0080557
4-Fluoro-2-((phenylthio)methyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1057218-85-5
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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
C₁₄H₁₁FO₂S
Molecular Weight
262.30
Synonyms
None
SMILES
FC1=CC=C(C(O)=O)C(CSC2=CC=CC=C2)=C1
Tpsa
37.3
Logp
3.8162
H Acceptors
2
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1057218-85-5 | 4-Fluoro-2-((phenylthio)methyl)benzoic acid | A2B Chem | -- |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₄H₁₁FO₂S
Molecular Weight: 262.30
Synonyms: None
SMILES: FC1=CC=C(C(O)=O)C(CSC2=CC=CC=C2)=C1
Tpsa: 37.3
Logp: 3.8162
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₁FO₂S
Molecular Weight:
262.30
Synonyms:
None
SMILES:
FC1=CC=C(C(O)=O)C(CSC2=CC=CC=C2)=C1
Tpsa:
37.3
Logp:
3.8162
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₀FN₃O₄S
Molecular Weight: 465.50
Synonyms: None
SMILES: OC(C(C=C1)=O)=C2N1N([C@@H]3C(C=CC=C4)=C4SCC5=C3C=CC(F)=C5)[C@H]6N(CCOC6)C2=O
Tpsa: 75.01
Logp: 2.8384
H Acceptors: 7
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:
C₂₄H₂₀FN₃O₄S
Molecular Weight:
465.50
Synonyms:
None
SMILES:
OC(C(C=C1)=O)=C2N1N([C@@H]3C(C=CC=C4)=C4SCC5=C3C=CC(F)=C5)[C@H]6N(CCOC6)C2=O
Tpsa:
75.01
Logp:
2.8384
H Acceptors:
7
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: C₂₄H₂₀FN₃O₄S
Molecular Weight: 465.50
Synonyms: None
SMILES: OC(C(C=C1)=O)=C2N1N([C@@H]3C(C=CC=C4)=C4SCC5=C3C=CC=C5F)[C@H]6N(CCOC6)C2=O
Tpsa: 75.01
Logp: 2.8384
H Acceptors: 7
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:
C₂₄H₂₀FN₃O₄S
Molecular Weight:
465.50
Synonyms:
None
SMILES:
OC(C(C=C1)=O)=C2N1N([C@@H]3C(C=CC=C4)=C4SCC5=C3C=CC=C5F)[C@H]6N(CCOC6)C2=O
Tpsa:
75.01
Logp:
2.8384
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00800565
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₉NO₂Se
Molecular Weight: 182.08
Synonyms: Methylselenocysteine; Se-Methylseleno-L-cysteine
SMILES: OC([C@@H](N)C[Se]C)=O
Tpsa: 63.32
Logp: -0.4311
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD00800565
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₉NO₂Se
Molecular Weight:
182.08
Synonyms:
Methylselenocysteine; Se-Methylseleno-L-cysteine
SMILES:
OC([C@@H](N)C[Se]C)=O
Tpsa:
63.32
Logp:
-0.4311
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3