CS-1003777
Acetylsalicylic Acid Impurity 11(Caffeylmalic Acid)
Manufacturer: ChemScene
CAS Number: 39015-77-5
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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
C₁₃H₁₂O₈
Molecular Weight
296.23
Synonyms
None
SMILES
O=C(OC(C(=O)O)CC(=O)O)C=CC1=CC=C(O)C(O)=C1
Tpsa
141.36
Logp
0.5821
H Acceptors
6
H Donors
4
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | Caffeoylmalic acid | Sigma Aldrich | ₹ 89,295.43 | |
 | 39015-77-5 | CAFFEOYLMALIC ACID | A2B Chem | -- |
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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: C₁₃H₁₂O₈
Molecular Weight: 296.23
Synonyms: None
SMILES: O=C(OC(C(=O)O)CC(=O)O)C=CC1=CC=C(O)C(O)=C1
Tpsa: 141.36
Logp: 0.5821
H Acceptors: 6
H Donors: 4
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:
C₁₃H₁₂O₈
Molecular Weight:
296.23
Synonyms:
None
SMILES:
O=C(OC(C(=O)O)CC(=O)O)C=CC1=CC=C(O)C(O)=C1
Tpsa:
141.36
Logp:
0.5821
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₉ClO₃
Molecular Weight: 164.59
Synonyms: None
SMILES: C(Cl)[C@@H]1C[C@@H](O)CC(=O)O1
Tpsa: 46.53
Logp: 0.2917
H Acceptors: 3
H Donors: 1
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:
C₆H₉ClO₃
Molecular Weight:
164.59
Synonyms:
None
SMILES:
C(Cl)[C@@H]1C[C@@H](O)CC(=O)O1
Tpsa:
46.53
Logp:
0.2917
H Acceptors:
3
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: C₁₀H₁₇ClO₄
Molecular Weight: 236.69
Synonyms: None
SMILES: C(C(OC)=O)[C@H]1C[C@@H](CCl)OC(C)(C)O1
Tpsa: 44.76
Logp: 1.6985
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:
C₁₀H₁₇ClO₄
Molecular Weight:
236.69
Synonyms:
None
SMILES:
C(C(OC)=O)[C@H]1C[C@@H](CCl)OC(C)(C)O1
Tpsa:
44.76
Logp:
1.6985
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: C₁₅H₁₁I₃O₄
Molecular Weight: 635.96
Synonyms: None
SMILES: O=C(O)CCC1=CC=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1
Tpsa: 66.76
Logp: 5.0155
H Acceptors: 3
H Donors: 2
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:
C₁₅H₁₁I₃O₄
Molecular Weight:
635.96
Synonyms:
None
SMILES:
O=C(O)CCC1=CC=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1
Tpsa:
66.76
Logp:
5.0155
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
5