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32755-44-5 | tert-Butyl 2-isocyano-3-phenylpropionate
CAS No: 32755-44-5 Catalog No: AG003UJG MDL No:
Product Description
Catalog Number:
AG003UJG
Chemical Name:
tert-Butyl 2-isocyano-3-phenylpropionate
CAS Number:
32755-44-5
IUPAC Name:
tert-butyl 2-isocyano-3-phenylpropanoate
InChI:
InChI=1S/C14H17NO2/c1-14(2,3)17-13(16)12(15-4)10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-3H3
InChI Key:
ZAWPEVUURWHHNZ-UHFFFAOYSA-N
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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