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622-29-7 | N-Benzylidenemethanamine
CAS No: 622-29-7 Catalog No: AG003SRV MDL No:MFCD00008294
Product Description
Catalog Number:
AG003SRV
Chemical Name:
N-Benzylidenemethanamine
CAS Number:
622-29-7
Molecular Formula:
C8H9N
Molecular Weight:
119.1638
MDL Number:
MFCD00008294
IUPAC Name:
N-methyl-1-phenylmethanimine
InChI:
InChI=1S/C8H9N/c1-9-7-8-5-3-2-4-6-8/h2-7H,1H3
InChI Key:
HXTGGPKOEKKUQO-UHFFFAOYSA-N
SMILES:
C/N=C/c1ccccc1
EC Number:
210-728-2
NSC Number:
69423
Properties
Complexity:
90.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
119.073g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
119.167g/mol
Monoisotopic Mass:
119.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Autocatalysis and surface catalysis in the reduction of imines by SmI2. | Journal of the American Chemical Society 20110921 |
| The reactivity of phosphagermaallene Tip(t-Bu)Ge=C=PMes* with doubly and triply bonded nitrogen compounds. | Inorganic chemistry 20101115 |
| Cyclometallation of amino-imines on palladium complexes. The effect of the solvent on the experimental and calculated mechanism. | Dalton transactions (Cambridge, England : 2003) 20091021 |
| A combined experimental and theoretical study of the polar [3 + 2] cycloaddition of electrophilically activated carbonyl ylides with aldehydes and imines. | The Journal of organic chemistry 20090306 |
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