Home Amines 1017046-27-3
1017046-27-3,MFCD09947725
Catalog No.:AA00056O
1017046-27-3 | 5-Benzoxazolamine, 2-(1,1-dimethylethyl)-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95.0%
3 weeks  
$239.00   $168.00
- +
500mg
95.0%
3 weeks  
$397.00   $278.00
- +
1g
95.0%
3 weeks  
$539.00   $378.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA00056O
Chemical Name:
5-Benzoxazolamine, 2-(1,1-dimethylethyl)-
CAS Number:
1017046-27-3
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
MDL Number:
MFCD09947725
IUPAC Name:
2-tert-butyl-1,3-benzoxazol-5-amine
InChI:
InChI=1S/C11H14N2O/c1-11(2,3)10-13-8-6-7(12)4-5-9(8)14-10/h4-6H,12H2,1-3H3
InChI Key:
YAIJJYNDSHDPIB-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)nc(o2)C(C)(C)C
Properties
Computed Properties
 
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.111g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.246g/mol
Monoisotopic Mass:
190.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
2-tert-butyl-1,3-benzoxazol-5-amine 
1017046-27-3 
5-Benzoxazolamine, 2-(1,1-dimethylethyl)- 
EN300-36092 
Z367678524 
5-Amino-2-(tert-butyl)benzoxazole 
AC1Q1MCT 
CTK4A0125 
DTXSID20640947 
ZINC19512439 
AKOS000192607 
MCULE-3055776239 
NE14677 
Literature
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