CS-1005427
Benzenebutanoic acid, 2-hydroxy-3,4-dimethoxy-6-methyl-5-(sulfooxy)-, potassium salt 1:2
Manufacturer: ChemScene
CAS Number: 95233-65-1
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₈KO₉S
Molecular Weight
389.44
Synonyms
None
SMILES
[K].O=C(O)CCCC1=C(O)C(OC)=C(OC)C(OS(=O)(=O)O)=C1C
Tpsa
139.59
Logp
0.92592
H Acceptors
7
H Donors
3
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 95233-65-1 | 2H-QS-4 Sulfate | 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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₈KO₉S
Molecular Weight: 389.44
Synonyms: None
SMILES: [K].O=C(O)CCCC1=C(O)C(OC)=C(OC)C(OS(=O)(=O)O)=C1C
Tpsa: 139.59
Logp: 0.92592
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 8
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈KO₉S
Molecular Weight:
389.44
Synonyms:
None
SMILES:
[K].O=C(O)CCCC1=C(O)C(OC)=C(OC)C(OS(=O)(=O)O)=C1C
Tpsa:
139.59
Logp:
0.92592
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂O₃
Molecular Weight: 180.20
Synonyms: None
SMILES: O=C(O)C=1C=CC=CC1C(O)CC
Tpsa: 57.53
Logp: 1.8282
H Acceptors: 2
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:
C₁₀H₁₂O₃
Molecular Weight:
180.20
Synonyms:
None
SMILES:
O=C(O)C=1C=CC=CC1C(O)CC
Tpsa:
57.53
Logp:
1.8282
H Acceptors:
2
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: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: None
SMILES: [C@H](CCC)(O)C1=C(C(O)=O)C=CC=C1
Tpsa: 57.53
Logp: 2.2183
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
None
SMILES:
[C@H](CCC)(O)C1=C(C(O)=O)C=CC=C1
Tpsa:
57.53
Logp:
2.2183
H Acceptors:
2
H Donors:
2
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: C₁₃H₁₈O₃
Molecular Weight: 222.28
Synonyms: None
SMILES: [C@H](CCCCC)(O)C1=C(C(O)=O)C=CC=C1
Tpsa: 57.53
Logp: 2.9985
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈O₃
Molecular Weight:
222.28
Synonyms:
None
SMILES:
[C@H](CCCCC)(O)C1=C(C(O)=O)C=CC=C1
Tpsa:
57.53
Logp:
2.9985
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
6