2227-57-8,MFCD00181523
Catalog No.:AA00BV5S

2227-57-8 | 3-(4-Methoxyphenyl)-2-propynoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$43.00   $31.00
- +
1g
95%
in stock  
$412.00   $288.00
- +
5g
95%
in stock  
$706.00   $494.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00BV5S
Chemical Name:
3-(4-Methoxyphenyl)-2-propynoic acid
CAS Number:
2227-57-8
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD00181523
SMILES:
COc1ccc(cc1)C#CC(=O)O
NSC Number:
61877
Properties
Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
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
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Additional Info:
SDS
Tags:2227-57-8 Molecular Formula|2227-57-8 MDL|2227-57-8 SMILES|2227-57-8 3-(4-Methoxyphenyl)-2-propynoic acid
Catalog No.: AA00BV5S
2227-57-8,MFCD00181523
2227-57-8 | 3-(4-Methoxyphenyl)-2-propynoic acid
Pack Size: 100mg
Purity: 95%
in stock
$43.00 $31.00
Pack Size: 1g
Purity: 95%
in stock
$412.00 $288.00
Pack Size: 5g
Purity: 95%
in stock
$706.00 $494.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00BV5S
Chemical Name: 3-(4-Methoxyphenyl)-2-propynoic acid
CAS Number: 2227-57-8
Molecular Formula: C10H8O3
Molecular Weight: 176.1687
MDL Number: MFCD00181523
SMILES: COc1ccc(cc1)C#CC(=O)O
NSC Number: 61877
Properties
Complexity: 237  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 3  
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  
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