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827613-88-7

827613-88-7 | 1-Propen-1-one, 3-[(1,1-dimethylethyl)imino]-2-methyl-3-phenyl-, (3E)-

CAS No: 827613-88-7 Catalog No: AG004Y50 MDL No:

Product Description

Catalog Number:
AG004Y50
Chemical Name:
1-Propen-1-one, 3-[(1,1-dimethylethyl)imino]-2-methyl-3-phenyl-, (3E)-
CAS Number:
827613-88-7
Molecular Formula:
C14H17NO
Molecular Weight:
215.2909
IUPAC Name:
3-tert-butylimino-2-methyl-3-phenylprop-1-en-1-one
InChI:
InChI=1S/C14H17NO/c1-11(10-16)13(15-14(2,3)4)12-8-6-5-7-9-12/h5-9H,1-4H3
InChI Key:
VWGXMTGCROJVLB-UHFFFAOYSA-N
SMILES:
O=C=C(/C(=N/C(C)(C)C)/c1ccccc1)C

Properties

Complexity:
310  
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.131g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.296g/mol
Monoisotopic Mass:
215.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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