CS-0767087
(3-Oxocyclohexen-1-yl) 2-chloro-4-methylsulfonylbenzoate
Manufacturer: ChemScene
CAS Number: 114911-83-0
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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
C₁₄H₁₃ClO₅S
Molecular Weight
328.77
Synonyms
None
SMILES
CS(=O)(=O)C1=CC(Cl)=C(C=C1)C(=O)OC1=CC(=O)CCC1
Tpsa
77.51
Logp
2.5372
H Acceptors
5
H Donors
0
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 114911-83-0 | Benzoic acid, 2-chloro-4-(methylsulfonyl)-, 3-oxo-1-cyclohexen-1-yl ester | A2B Chem | -- |
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: C₁₄H₁₃ClO₅S
Molecular Weight: 328.77
Synonyms: None
SMILES: CS(=O)(=O)C1=CC(Cl)=C(C=C1)C(=O)OC1=CC(=O)CCC1
Tpsa: 77.51
Logp: 2.5372
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:
C₁₄H₁₃ClO₅S
Molecular Weight:
328.77
Synonyms:
None
SMILES:
CS(=O)(=O)C1=CC(Cl)=C(C=C1)C(=O)OC1=CC(=O)CCC1
Tpsa:
77.51
Logp:
2.5372
H Acceptors:
5
H Donors:
0
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: C₈H₁₀ClN₅O
Molecular Weight: 227.65
Synonyms: None
SMILES: CN1C=NC2=NC(Cl)=NC(NCCO)=C12
Tpsa: 75.86
Logp: 0.4209
H Acceptors: 6
H Donors: 2
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:
C₈H₁₀ClN₅O
Molecular Weight:
227.65
Synonyms:
None
SMILES:
CN1C=NC2=NC(Cl)=NC(NCCO)=C12
Tpsa:
75.86
Logp:
0.4209
H Acceptors:
6
H Donors:
2
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: C₈H₄Cl₅NO
Molecular Weight: 307.39
Synonyms: None
SMILES: ClCC(=O)NC1=C(Cl)C(Cl)=CC(Cl)=C1Cl
Tpsa: 29.1
Logp: 4.4775
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄Cl₅NO
Molecular Weight:
307.39
Synonyms:
None
SMILES:
ClCC(=O)NC1=C(Cl)C(Cl)=CC(Cl)=C1Cl
Tpsa:
29.1
Logp:
4.4775
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈O₇
Molecular Weight: 216.14
Synonyms: None
SMILES: COC(=O)C1=C(C(=O)OC)C(=O)OC1O
Tpsa: 99.13
Logp: -1.4958
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈O₇
Molecular Weight:
216.14
Synonyms:
None
SMILES:
COC(=O)C1=C(C(=O)OC)C(=O)OC1O
Tpsa:
99.13
Logp:
-1.4958
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
2