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106690-33-9,MFCD03422207
Catalog No.:AA007BT3

106690-33-9 | (1,3-Benzodioxol-5-yloxy)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$245.00   $172.00
- +
5g
95%
in stock  
$978.00   $685.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA007BT3
Chemical Name:
(1,3-Benzodioxol-5-yloxy)acetic acid
CAS Number:
106690-33-9
Molecular Formula:
C9H8O5
Molecular Weight:
196.1568
MDL Number:
MFCD03422207
SMILES:
OC(=O)COc1ccc2c(c1)OCO2
Properties
Computed Properties
 
Complexity:
217  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.2  

Downstream Synthesis Route
533-31-3    106690-33-9   
3,4-methylenedioxyphenoxyaceticacid(3,4-methylenedioxy)phenylester 

[1]Bian,Xiao-Li;Liu,Ji-Ping;Shi,Yong-Heng;Sun,Meng;Wang,Bin;Wang,Wei;Wang,Xiao-Ping;Xie,Yun-Dong;Xu,Xin-Ya;Xu,Yan-Hong[BioorganicandMedicinalChemistryLetters,2021,vol.43]

[2]Xie,Yundong;Liu,Jiping;Shi,Yongheng;Wang,Bin;Wang,Xiaoping;Wang,Wei;Sun,Meng;Xu,Xinya;Cheng,Lifei;He,Shipeng[BioorganicChemistry,2021,vol.117]

Literature
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Additional Info:
SDS
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Tags:106690-33-9 Molecular Formula|106690-33-9 MDL|106690-33-9 SMILES|106690-33-9 (1,3-Benzodioxol-5-yloxy)acetic acid