78710-55-1,MFCD00040753
Catalog No.:AA005JTU

78710-55-1 | (3,5-Dimethylphenyl)methanamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$58.00   $40.00
- +
1g
97%
in stock  
$86.00   $60.00
- +
5g
97%
in stock  
$256.00   $179.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005JTU
Chemical Name:
(3,5-Dimethylphenyl)methanamine
CAS Number:
78710-55-1
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
MDL Number:
MFCD00040753
SMILES:
NCc1cc(C)cc(c1)C
Properties
Properties
 
BP:
220.7°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
90.9  
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:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.5  

Downstream Synthesis Route
7560-50-1    78710-55-1   
(E)-3-(4-(E)-3,5-Dimethyl-benzylimino-methyl}-phenyl)-acrylicacidmethylester 

[1]OrganicLetters,2005,vol.7,p.1199-1202

[1]JournalofMedicinalChemistry,2008,vol.51,p.3985-4001

1201-07-6    78710-55-1   
8-bromo-N-(3,5-dimethylbenzyl)-2-methylquinolin-4-amine 

[1]JournalofMedicinalChemistry,2015,vol.58,p.7021-7056

[1]GreenChemistry,2019,vol.21,p.1390-1395

33089-36-0    27129-86-8    78710-55-1   
CASUnavailable 

[1]Power,MartinJ.;Morris,DavidT.J.;Vitorica-Yrezabal,IñigoJ.;Leigh,DavidA.[JournaloftheAmericanChemicalSociety,2023]

Literature

Title: Highly selective and high-yielding rotaxane synthesis via aminolysis of prerotaxanes consisting of a ring component and a stopper unit.

Journal: Organic letters 20070802

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Additional Info:
SDS
Tags:78710-55-1 Molecular Formula|78710-55-1 MDL|78710-55-1 SMILES|78710-55-1 (3,5-Dimethylphenyl)methanamine
Catalog No.: AA005JTU
78710-55-1,MFCD00040753
78710-55-1 | (3,5-Dimethylphenyl)methanamine
Pack Size: 250mg
Purity: 95%
in stock
$58.00 $40.00
Pack Size: 1g
Purity: 97%
in stock
$86.00 $60.00
Pack Size: 5g
Purity: 97%
in stock
$256.00 $179.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005JTU
Chemical Name: (3,5-Dimethylphenyl)methanamine
CAS Number: 78710-55-1
Molecular Formula: C9H13N
Molecular Weight: 135.2062
MDL Number: MFCD00040753
SMILES: NCc1cc(C)cc(c1)C
Properties
BP: 220.7°C at 760 mmHg  
Storage: Keep in dry area;2-8℃;  
Complexity: 90.9  
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: 1  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.5  
Downstream Synthesis Route
7560-50-1    78710-55-1   
(E)-3-(4-(E)-3,5-Dimethyl-benzylimino-methyl}-phenyl)-acrylicacidmethylester 

[1]OrganicLetters,2005,vol.7,p.1199-1202

4066-41-5    78710-55-1    67715-76-8    1039454-47-1 

[1]JournalofMedicinalChemistry,2008,vol.51,p.3985-4001

1201-07-6    78710-55-1   
8-bromo-N-(3,5-dimethylbenzyl)-2-methylquinolin-4-amine 

[1]JournalofMedicinalChemistry,2015,vol.58,p.7021-7056

22445-42-7    78710-55-1 

[1]GreenChemistry,2019,vol.21,p.1390-1395

33089-36-0    27129-86-8    78710-55-1   
CASUnavailable 

[1]Power,MartinJ.;Morris,DavidT.J.;Vitorica-Yrezabal,IñigoJ.;Leigh,DavidA.[JournaloftheAmericanChemicalSociety,2023]

Literature fold

Title: Highly selective and high-yielding rotaxane synthesis via aminolysis of prerotaxanes consisting of a ring component and a stopper unit.

Journal: Organic letters20070802

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