Home Fluorides 590417-81-5
590417-81-5,MFCD08442708
Catalog No.:AA00ECJZ

590417-81-5 | Benzenemethanol, 3-fluoro-4-methoxy-alpha-methyl- (9CI)

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100mg
97%
1 week  
$66.00   $46.00
- +
250mg
97%
1 week  
$111.00   $78.00
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1g
97%
1 week  
$297.00   $208.00
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5g
97%
1 week  
$1,041.00   $729.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00ECJZ
Chemical Name:
Benzenemethanol, 3-fluoro-4-methoxy-alpha-methyl- (9CI)
CAS Number:
590417-81-5
Molecular Formula:
C9H11FO2
Molecular Weight:
170.1808
MDL Number:
MFCD08442708
SMILES:
COc1ccc(cc1F)C(O)C
Properties
Properties
 
Form:
Liquid  

Computed Properties
 
Complexity:
141  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.5  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartDas,Biswanath;Veeranjaneyulu,Boyapati;Krishnaiah,Maddeboina;Balasubramanyam[SyntheticCommunications,2009,vol.39,#11,p.1929-1935]

19009-39-3    590417-81-5   
C16H24FNO3 

[1]Roesner,Stefan;Blair,DanielJ.;Aggarwal,VarinderK.[ChemicalScience,2015,vol.6,#7,p.3718-3723]

[1]Roesner,Stefan;Blair,DanielJ.;Aggarwal,VarinderK.[ChemicalScience,2015,vol.6,#7,p.3718-3723]

[2]Qiu,Xu;Wang,Yachong;Su,Lingyu;Jin,Rui;Song,Song;Qin,Qixue;Li,Junhua;Zong,Baoning;Jiao,Ning[ChineseJournalofChemistry,2021,vol.39,#11,p.3011-3016]

590417-81-5   
C16H23(2)HFNO3 

[1]Roesner,Stefan;Blair,DanielJ.;Aggarwal,VarinderK.[ChemicalScience,2015,vol.6,#7,p.3718-3723]

[1]Tsai,Pei-Yi;Hu,Gong-Siang;Huang,Po-Hsun;Jheng,Huei-Lin;Lan,Chi-Hsuan;Chen,You-Sin;Chang,Jia-Ming;Chuang,Shih-Hsien;Huang,Jiann-Jyh[JournaloftheChineseChemicalSociety,2021,vol.68,#9,p.1761-1770]

Literature
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SDS
Tags:590417-81-5 Molecular Formula|590417-81-5 MDL|590417-81-5 SMILES|590417-81-5 Benzenemethanol, 3-fluoro-4-methoxy-alpha-methyl- (9CI)