Home Amines 100054-14-6
100054-14-6,MFCD11138705
Catalog No.:AA0000N9
Benzenamine, N-(1,2-dimethylpropyl)- | 100054-14-6
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
1 week  
$116.00
- +
250mg
95.0%
1 week  
$153.00
- +
500mg
95.0%
1 week  
$261.00
- +
1g
95.0%
1 week  
$365.00
- +
2.5g
95.0%
1 week  
$687.00
- +
5g
95.0%
1 week  
$1,001.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000N9
Chemical Name:
Benzenamine, N-(1,2-dimethylpropyl)-
CAS Number:
100054-14-6
Molecular Formula:
C11H17N
Molecular Weight:
163.2594
MDL Number:
MFCD11138705
IUPAC Name:
N-(3-methylbutan-2-yl)aniline
InChI:
InChI=1S/C11H17N/c1-9(2)10(3)12-11-7-5-4-6-8-11/h4-10,12H,1-3H3
InChI Key:
HLYASKUOTVQVGX-UHFFFAOYSA-N
SMILES:
CC(C(C)C)Nc1ccccc1
Properties
Computed Properties
 
Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.136g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.264g/mol
Monoisotopic Mass:
163.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

Synonyms
 
N-(3-Methylbutan-2-yl)aniline 
100054-14-6 
Z1442598272 
Benzenamine, N-(1,2-dimethylpropyl)- 
ACMC-20m34f 
SCHEMBL2255556 
N-(1,2-Dimethylpropyl)aniline 
CTK0G9124 
DTXSID20564811 
AKOS000228657 
AKOS026730575 
Literature
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