CS-0767787
Methyl 2-((Cyanomethyl)sulfonyl)benzoate
Manufacturer: ChemScene
CAS Number: 175137-52-7
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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
C₁₀H₉NO₄S
Molecular Weight
239.25
Synonyms
None
SMILES
COC(=O)C1=C(C=CC=C1)S(=O)(=O)CC#N
Tpsa
84.23
Logp
0.77048
H Acceptors
5
H Donors
0
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 175137-52-7 | Benzoic acid, 2-[(cyanomethyl)sulfonyl]-, methyl ester | A2B Chem | -- |
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
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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: C₁₀H₉NO₄S
Molecular Weight: 239.25
Synonyms: None
SMILES: COC(=O)C1=C(C=CC=C1)S(=O)(=O)CC#N
Tpsa: 84.23
Logp: 0.77048
H Acceptors: 5
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:
C₁₀H₉NO₄S
Molecular Weight:
239.25
Synonyms:
None
SMILES:
COC(=O)C1=C(C=CC=C1)S(=O)(=O)CC#N
Tpsa:
84.23
Logp:
0.77048
H Acceptors:
5
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: C₁₂H₁₀Cl₂N₂O₂
Molecular Weight: 285.13
Synonyms: None
SMILES: COC(=O)C1=CC(CN2C=NC(Cl)=C2Cl)=CC=C1
Tpsa: 44.12
Logp: 3.0248
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:
C₁₂H₁₀Cl₂N₂O₂
Molecular Weight:
285.13
Synonyms:
None
SMILES:
COC(=O)C1=CC(CN2C=NC(Cl)=C2Cl)=CC=C1
Tpsa:
44.12
Logp:
3.0248
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: C₁₂H₁₄N₂O₄
Molecular Weight: 250.25
Synonyms: None
SMILES: COC(=O)C1=CC(NC(C)=O)=C(NC(C)=O)C=C1
Tpsa: 84.5
Logp: 1.39
H Acceptors: 4
H Donors: 2
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:
C₁₂H₁₄N₂O₄
Molecular Weight:
250.25
Synonyms:
None
SMILES:
COC(=O)C1=CC(NC(C)=O)=C(NC(C)=O)C=C1
Tpsa:
84.5
Logp:
1.39
H Acceptors:
4
H Donors:
2
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: C₁₃H₁₆O₅
Molecular Weight: 252.26
Synonyms: None
SMILES: CCC(=O)C1=C(C=C(OC)C=C1OC)C(=O)OC
Tpsa: 61.83
Logp: 2.0831
H Acceptors: 5
H Donors: 0
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:
C₁₃H₁₆O₅
Molecular Weight:
252.26
Synonyms:
None
SMILES:
CCC(=O)C1=C(C=C(OC)C=C1OC)C(=O)OC
Tpsa:
61.83
Logp:
2.0831
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
5