Home Other Building Blocks 3-(4-tert-butylphenyl)-1,2-oxazol-5-amine

3-(4-tert-butylphenyl)-1,2-oxazol-5-amine

CAS No.:
794566-80-6
Catalog Number:
AG01AAGH
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
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Product Description
Catalog Number:
AG01AAGH
Chemical Name:
3-(4-tert-butylphenyl)-1,2-oxazol-5-amine
CAS Number:
794566-80-6
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
MDL Number:
MFCD07382880
IUPAC Name:
3-(4-tert-butylphenyl)-1,2-oxazol-5-amine
InChI:
InChI=1S/C13H16N2O/c1-13(2,3)10-6-4-9(5-7-10)11-8-12(14)16-15-11/h4-8H,14H2,1-3H3
InChI Key:
BDMVJTHOQVOKDB-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)c1noc(c1)N)(C)C
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.284g/mol
Monoisotopic Mass:
216.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties