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84540-50-1,MFCD03094650
Catalog No.:AA004R7M

84540-50-1 | 2-Chloro-4-methyl-3-hydroxyaniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%(GC)
in stock  
$24.00   $17.00
- +
25g
98%(GC)
in stock  
$35.00   $25.00
- +
100g
97%
in stock  
$91.00 $64.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA004R7M
Chemical Name:
2-Chloro-4-methyl-3-hydroxyaniline
CAS Number:
84540-50-1
Molecular Formula:
C7H8ClNO
Molecular Weight:
157.5975
MDL Number:
MFCD03094650
SMILES:
Cc1ccc(c(c1O)Cl)N
Properties
Properties
 
BP:
262.7°C at 760 mmHg  
Form:
Solid  
MP:
80-83 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
120  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ICAHNSCHOOLOFMEDICINEATMOUNTSINAI-WO2012/116170,2012,A1Locationinpatent:Page/Pagecolumn69

[2]Zhang,Guangtao;Plotnikov,AlexanderN.;Rusinova,Elena;Shen,Tong;Morohashi,Keita;Joshua,Jennifer;Zeng,Lei;Mujtaba,Shiraz;Ohlmeyer,Michael;Zhou,Ming-Ming[JournalofMedicinalChemistry,2013,vol.56,#22,p.9251-9264]

Literature

Title: Final report on the safety assessment of 6-Amino-m-Cresol, 6-Amino-o-Cresol, 4-Amino-m-Cresol, 5-Amino-4-Chloro-o-Cresol, 5-Amino-6-Chloro-o-Cresol, and 4-Chloro-2-Aminophenol.

Journal: International journal of toxicology 20040101

Quotation Request
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SDS
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Tags:84540-50-1 Molecular Formula|84540-50-1 MDL|84540-50-1 SMILES|84540-50-1 2-Chloro-4-methyl-3-hydroxyaniline
Catalog No.: AA004R7M
84540-50-1,MFCD03094650
84540-50-1 | 2-Chloro-4-methyl-3-hydroxyaniline
Pack Size： 5g
Purity： 98%(GC)
in stock
$24.00 $17.00
Pack Size： 25g
Purity： 98%(GC)
in stock
$35.00 $25.00
Pack Size： 100g
Purity： 97%
in stock
$91.00 $64.00
Quantity
- +
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Technical Information
Catalog Number: AA004R7M
Chemical Name: 2-Chloro-4-methyl-3-hydroxyaniline
CAS Number: 84540-50-1
Molecular Formula: C7H8ClNO
Molecular Weight: 157.5975
MDL Number: MFCD03094650
SMILES: Cc1ccc(c(c1O)Cl)N
Properties
BP: 262.7°C at 760 mmHg  
Form: Solid  
MP: 80-83 °C  
Storage: Keep in dry area;2-8℃;  
Complexity: 120  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.9  
Downstream Synthesis Route
84540-50-1    144-83-2    1395084-37-3 

[1]CurrentPatentAssignee:ICAHNSCHOOLOFMEDICINEATMOUNTSINAI-WO2012/116170,2012,A1Locationinpatent:Page/Pagecolumn69

[2]Zhang,Guangtao;Plotnikov,AlexanderN.;Rusinova,Elena;Shen,Tong;Morohashi,Keita;Joshua,Jennifer;Zeng,Lei;Mujtaba,Shiraz;Ohlmeyer,Michael;Zhou,Ming-Ming[JournalofMedicinalChemistry,2013,vol.56,#22,p.9251-9264]

Literature fold

Title: Final report on the safety assessment of 6-Amino-m-Cresol, 6-Amino-o-Cresol, 4-Amino-m-Cresol, 5-Amino-4-Chloro-o-Cresol, 5-Amino-6-Chloro-o-Cresol, and 4-Chloro-2-Aminophenol.

Journal: International journal of toxicology20040101

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