492-38-6,MFCD00046531
Catalog No.:AA0033CL

492-38-6 | Atropic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$18.00   $13.00
- +
5g
98%
in stock  
$35.00   $25.00
- +
25g
98%
in stock  
$70.00   $49.00
- +
100g
98%
in stock  
$181.00   $127.00
- +
500g
98%
in stock  
$691.00 $484.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0033CL
Chemical Name:
Atropic acid
CAS Number:
492-38-6
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
MDL Number:
MFCD00046531
SMILES:
C=C(c1ccccc1)C(=O)O
NSC Number:
20987
Properties
Properties
 
BP:
267.8°C at 760 mmHg  
Form:
Solid  
MP:
106-107°  
Refractive Index:
1.5049 (estimate)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
166  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2  

Literature

Title: Insights into the novel hydrolytic mechanism of a diethyl 2-phenyl-2-(2-arylacetoxy)methyl malonate ester-based microsomal triglyceride transfer protein (MTP) inhibitor.

Journal: Chemical research in toxicology 20121015

Title: (-)-(S)-Nakinadine B: first asymmetric synthesis.

Journal: Chemical communications (Cambridge, England) 20120925

Title: Methyl (E)-2-[(2-nitro-phen-oxy)meth-yl]-3-phenyl-acrylate.

Journal: Acta crystallographica. Section E, Structure reports online 20120601

Title: Two new compounds from the roots of Ilex pubescens.

Journal: Natural product research 20120101

Title: (E)-Methyl 2-[(2-formyl-6-meth-oxy-phen-oxy)meth-yl]-3-phenyl-acrylate.

Journal: Acta crystallographica. Section E, Structure reports online 20120101

Title: Rapid resolution liquid chromatography for monitoring the quality of stockpiled atropine preparations for injection.

Journal: Drug testing and analysis 20120101

Title: Phytochemicals and biological studies of plants from the genus Balanophora.

Journal: Chemistry Central journal 20120101

Title: (E)-Methyl 2-[(4-bromo-2-formyl-phen-oxy)meth-yl]-3-phenyl-acrylate.

Journal: Acta crystallographica. Section E, Structure reports online 20111201

Title: Theoretical investigation of novel carbazole-fluorene based D-π-A conjugated organic dyes as dye-sensitizer in dye-sensitized solar cells (DSCs).

Journal: Journal of computational chemistry 20110601

Title: Impurity profiling of atropine sulfate by microemulsion electrokinetic chromatography.

Journal: Journal of pharmaceutical and biomedical analysis 20070727

Title: Stability and comparative metabolism of selected felbamate metabolites and postulated fluorofelbamate metabolites by postmitochondrial suspensions.

Journal: Chemical research in toxicology 20051201

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SDS
Tags:492-38-6 Molecular Formula|492-38-6 MDL|492-38-6 SMILES|492-38-6 Atropic acid
Catalog No.: AA0033CL
492-38-6,MFCD00046531
492-38-6 | Atropic acid
Pack Size: 1g
Purity: 95%
in stock
$18.00 $13.00
Pack Size: 5g
Purity: 98%
in stock
$35.00 $25.00
Pack Size: 25g
Purity: 98%
in stock
$70.00 $49.00
Pack Size: 100g
Purity: 98%
in stock
$181.00 $127.00
Pack Size: 500g
Purity: 98%
in stock
$691.00 $484.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0033CL
Chemical Name: Atropic acid
CAS Number: 492-38-6
Molecular Formula: C9H8O2
Molecular Weight: 148.1586
MDL Number: MFCD00046531
SMILES: C=C(c1ccccc1)C(=O)O
NSC Number: 20987
Properties
BP: 267.8°C at 760 mmHg  
Form: Solid  
MP: 106-107°  
Refractive Index: 1.5049 (estimate)  
Storage: Keep in dry area;2-8℃;  
Complexity: 166  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2  
Literature fold

Title: Insights into the novel hydrolytic mechanism of a diethyl 2-phenyl-2-(2-arylacetoxy)methyl malonate ester-based microsomal triglyceride transfer protein (MTP) inhibitor.

Journal: Chemical research in toxicology20121015

Title: (-)-(S)-Nakinadine B: first asymmetric synthesis.

Journal: Chemical communications (Cambridge, England)20120925

Title: Methyl (E)-2-[(2-nitro-phen-oxy)meth-yl]-3-phenyl-acrylate.

Journal: Acta crystallographica. Section E, Structure reports online20120601

Title: Two new compounds from the roots of Ilex pubescens.

Journal: Natural product research20120101

Title: (E)-Methyl 2-[(2-formyl-6-meth-oxy-phen-oxy)meth-yl]-3-phenyl-acrylate.

Journal: Acta crystallographica. Section E, Structure reports online20120101

Title: Rapid resolution liquid chromatography for monitoring the quality of stockpiled atropine preparations for injection.

Journal: Drug testing and analysis20120101

Title: Phytochemicals and biological studies of plants from the genus Balanophora.

Journal: Chemistry Central journal20120101

Title: (E)-Methyl 2-[(4-bromo-2-formyl-phen-oxy)meth-yl]-3-phenyl-acrylate.

Journal: Acta crystallographica. Section E, Structure reports online20111201

Title: Theoretical investigation of novel carbazole-fluorene based D-π-A conjugated organic dyes as dye-sensitizer in dye-sensitized solar cells (DSCs).

Journal: Journal of computational chemistry20110601

Title: Impurity profiling of atropine sulfate by microemulsion electrokinetic chromatography.

Journal: Journal of pharmaceutical and biomedical analysis20070727

Title: Stability and comparative metabolism of selected felbamate metabolites and postulated fluorofelbamate metabolites by postmitochondrial suspensions.

Journal: Chemical research in toxicology20051201

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