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76518-57-5,MFCD03840599
Catalog No.:AA005BIM

76518-57-5 | 5-Hydroxymethylisoquinoline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$53.00   $37.00
- +
250mg
95%
in stock  
$88.00   $62.00
- +
1g
95%
in stock  
$228.00   $160.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005BIM
Chemical Name:
5-Hydroxymethylisoquinoline
CAS Number:
76518-57-5
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD03840599
SMILES:
OCc1cccc2c1ccnc2
Properties
Properties
 
BP:
352.3°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
149  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.2  

Downstream Synthesis Route
5632-13-3    58794-09-5   
5-and7-carboxymethylisoquinoline 
  6737-42-4    76518-57-5 

[1]Patent:US2002/6923,2002,A1

[1]Patent:WO2005/18557,2005,A2.Locationinpatent:Page/Pagecolumn293

[2]JournalofMedicinalChemistry,2015,vol.58,p.2114-2134

[3]Patent:US2012/214837,2012,A1.Locationinpatent:Page/Pagecolumn37

[4]Patent:US2019/31624,2019,A1.Locationinpatent:Paragraph0472-0473

[1]Jin,Yushu;Makida,Yusuke;Uchida,Tatsuya;Kuwano,Ryoichi[JournalofOrganicChemistry,2018,vol.83,#7,p.3829-3839]

Literature
Quotation Request
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SDS
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Tags:76518-57-5 Molecular Formula|76518-57-5 MDL|76518-57-5 SMILES|76518-57-5 5-Hydroxymethylisoquinoline
Catalog No.: AA005BIM
76518-57-5,MFCD03840599
76518-57-5 | 5-Hydroxymethylisoquinoline
Pack Size： 100mg
Purity： 95%
in stock
$53.00 $37.00
Pack Size： 250mg
Purity： 95%
in stock
$88.00 $62.00
Pack Size： 1g
Purity： 95%
in stock
$228.00 $160.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005BIM
Chemical Name: 5-Hydroxymethylisoquinoline
CAS Number: 76518-57-5
Molecular Formula: C10H9NO
Molecular Weight: 159.1846
MDL Number: MFCD03840599
SMILES: OCc1cccc2c1ccnc2
Properties
BP: 352.3°C at 760 mmHg  
Form: Solid  
Storage: Keep in dry area;Room Temperature;  
Complexity: 149  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.2  
Downstream Synthesis Route
5632-13-3    58794-09-5   
5-and7-carboxymethylisoquinoline 
  6737-42-4    76518-57-5 

[1]Patent:US2002/6923,2002,A1

80278-67-7    76518-57-5 

[1]Patent:WO2005/18557,2005,A2.Locationinpatent:Page/Pagecolumn293

[2]JournalofMedicinalChemistry,2015,vol.58,p.2114-2134

[3]Patent:US2012/214837,2012,A1.Locationinpatent:Page/Pagecolumn37

[4]Patent:US2019/31624,2019,A1.Locationinpatent:Paragraph0472-0473

16675-59-5    76518-57-5 

[1]Jin,Yushu;Makida,Yusuke;Uchida,Tatsuya;Kuwano,Ryoichi[JournalofOrganicChemistry,2018,vol.83,#7,p.3829-3839]

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