CS-0851135
3-[(2,2,2-Trifluoroethyl)sulphanyl]benzoic acid
Manufacturer: ChemScene
CAS Number: 1343934-85-9
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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
C₉H₇F₃O₂S
Molecular Weight
236.21
Synonyms
None
SMILES
O=C(O)C1=CC=CC(SCC(F)(F)F)=C1
Tpsa
37.3
Logp
3.0392
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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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: C₉H₇F₃O₂S
Molecular Weight: 236.21
Synonyms: None
SMILES: O=C(O)C1=CC=CC(SCC(F)(F)F)=C1
Tpsa: 37.3
Logp: 3.0392
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇F₃O₂S
Molecular Weight:
236.21
Synonyms:
None
SMILES:
O=C(O)C1=CC=CC(SCC(F)(F)F)=C1
Tpsa:
37.3
Logp:
3.0392
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₄N₂O
Molecular Weight: 130.19
Synonyms: None
SMILES: CC(C)(C)C/C(N)=N/O
Tpsa: 58.61
Logp: 1.169
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₄N₂O
Molecular Weight:
130.19
Synonyms:
None
SMILES:
CC(C)(C)C/C(N)=N/O
Tpsa:
58.61
Logp:
1.169
H Acceptors:
2
H Donors:
2
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: C₁₄H₁₄BrNO₃
Molecular Weight: 324.17
Synonyms: None
SMILES: COC(=O)C1=CC(Br)=CC2=C1C(C=O)=CN2C(C)C
Tpsa: 48.3
Logp: 3.5838
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₄BrNO₃
Molecular Weight:
324.17
Synonyms:
None
SMILES:
COC(=O)C1=CC(Br)=CC2=C1C(C=O)=CN2C(C)C
Tpsa:
48.3
Logp:
3.5838
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₄N₂O
Molecular Weight: 226.27
Synonyms: None
SMILES: CC1=CC=C(C2=CC=C(/C(N)=N/O)C=C2)C=C1
Tpsa: 58.61
Logp: 2.75652
H Acceptors: 2
H Donors: 2
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:
C₁₄H₁₄N₂O
Molecular Weight:
226.27
Synonyms:
None
SMILES:
CC1=CC=C(C2=CC=C(/C(N)=N/O)C=C2)C=C1
Tpsa:
58.61
Logp:
2.75652
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2