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96-15-1,MFCD00008147
Catalog No.:AA00IJNC

96-15-1 | 2-Methylbutylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
85%
in stock  
$51.00   $36.00
- +
5g
85%
in stock  
$123.00   $86.00
- +
25g
85%
in stock  
$456.00 $319.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IJNC
Chemical Name:
2-Methylbutylamine
CAS Number:
96-15-1
Molecular Formula:
C5H13N
Molecular Weight:
87.1634
MDL Number:
MFCD00008147
SMILES:
CCC(CN)C
FEMA Number:
4241
Properties
Computed Properties
 
Complexity:
27.1  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route
96-15-1    89534-40-7   
3-Ethylsulfanyl-N-(2-methyl-butyl)-butyramide 

[1]Desai,ManojC.;Stramiello,LindaM.Stephens[TetrahedronLetters,1993,vol.34,#48,p.7685-7688]

96-15-1    18595-13-6    503-38-8   
2-Methyl-6-3-(2-methyl-butyl)-ureido-benzoicacidmethylester 

[1]JournalofMedicinalChemistry,1990,vol.33,p.464-479

96-15-1    22134-07-2   
C12H15Cl3N2S 

[1]CurrentPatentAssignee:BAYERAG-US6353006,2002,B1Locationinpatent:Pagecolumn174

[1]Patent:US2003/171561,2003,A1

96-15-1    1191-16-8   
C10H21N 
  960246-17-7 

[1]Dubovyk,Igor;Watson,IainD.G.;Yudin,AndreiK.[JournaloftheAmericanChemicalSociety,2007,vol.129,#46,p.14172-14173]

Literature

Title: Gas chromatography-mass spectrometry assessment of amines in Port wine and grape juice after fast chloroformate extraction/derivatization.

Journal: Journal of agricultural and food chemistry 20110824

Title: Nakijiquinones J--R, sesquiterpenoid quinones with an amine residue from okinawan marine sponges.

Journal: Journal of natural products 20100326

Title: Chiral recognition in cucurbituril cavities.

Journal: Journal of the American Chemical Society 20061122

Title: Inhibition of nucleoside transport proteins by C8-alkylamine-substituted purines.

Journal: Journal of medicinal chemistry 20050113

Title: DNA interactions of new antitumor platinum complexes with trans geometry activated by a 2-metylbutylamine or sec-butylamine ligand.

Journal: Biochemical pharmacology 20040315

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SDS
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Tags:96-15-1 Molecular Formula|96-15-1 MDL|96-15-1 SMILES|96-15-1 2-Methylbutylamine
Catalog No.: AA00IJNC
96-15-1,MFCD00008147
96-15-1 | 2-Methylbutylamine
Pack Size： 1g
Purity： 85%
in stock
$51.00 $36.00
Pack Size： 5g
Purity： 85%
in stock
$123.00 $86.00
Pack Size： 25g
Purity： 85%
in stock
$456.00 $319.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IJNC
Chemical Name: 2-Methylbutylamine
CAS Number: 96-15-1
Molecular Formula: C5H13N
Molecular Weight: 87.1634
MDL Number: MFCD00008147
SMILES: CCC(CN)C
FEMA Number: 4241
Properties
Complexity: 27.1  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 6  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
96-15-1    89534-40-7   
3-Ethylsulfanyl-N-(2-methyl-butyl)-butyramide 

[1]Desai,ManojC.;Stramiello,LindaM.Stephens[TetrahedronLetters,1993,vol.34,#48,p.7685-7688]

96-15-1    18595-13-6    503-38-8   
2-Methyl-6-3-(2-methyl-butyl)-ureido-benzoicacidmethylester 

[1]JournalofMedicinalChemistry,1990,vol.33,p.464-479

96-15-1    22134-07-2   
C12H15Cl3N2S 

[1]CurrentPatentAssignee:BAYERAG-US6353006,2002,B1Locationinpatent:Pagecolumn174

96-15-1    13290-96-5    150583-78-1 

[1]Patent:US2003/171561,2003,A1

96-15-1    1191-16-8   
C10H21N 
  960246-17-7 

[1]Dubovyk,Igor;Watson,IainD.G.;Yudin,AndreiK.[JournaloftheAmericanChemicalSociety,2007,vol.129,#46,p.14172-14173]

Literature fold

Title: Gas chromatography-mass spectrometry assessment of amines in Port wine and grape juice after fast chloroformate extraction/derivatization.

Journal: Journal of agricultural and food chemistry20110824

Title: Nakijiquinones J--R, sesquiterpenoid quinones with an amine residue from okinawan marine sponges.

Journal: Journal of natural products20100326

Title: Chiral recognition in cucurbituril cavities.

Journal: Journal of the American Chemical Society20061122

Title: Inhibition of nucleoside transport proteins by C8-alkylamine-substituted purines.

Journal: Journal of medicinal chemistry20050113

Title: DNA interactions of new antitumor platinum complexes with trans geometry activated by a 2-metylbutylamine or sec-butylamine ligand.

Journal: Biochemical pharmacology20040315

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1264616-23-0
1264616-23-0
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