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860621-29-0 | Benzeneethanimidamide, N-(1,1-dimethylethyl)-
CAS No: 860621-29-0 Catalog No: AG004PET MDL No:
Product Description
Catalog Number:
AG004PET
Chemical Name:
Benzeneethanimidamide, N-(1,1-dimethylethyl)-
CAS Number:
860621-29-0
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
IUPAC Name:
N'-tert-butyl-2-phenylethanimidamide
InChI:
InChI=1S/C12H18N2/c1-12(2,3)14-11(13)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H2,13,14)
InChI Key:
ZDOGRZQTNIGMTD-UHFFFAOYSA-N
SMILES:
N=C(Cc1ccccc1)NC(C)(C)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.29g/mol
Monoisotopic Mass:
190.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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