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115879-52-2 | Methanamine, N-[(2-methylphenyl)methylene]-, N-oxide (9CI)
CAS No: 115879-52-2 Catalog No: AG000H1R MDL No:
Product Description
Catalog Number:
AG000H1R
Chemical Name:
Methanamine, N-[(2-methylphenyl)methylene]-, N-oxide (9CI)
CAS Number:
115879-52-2
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
IUPAC Name:
N-methyl-1-(2-methylphenyl)methanimine oxide
InChI:
InChI=1S/C9H11NO/c1-8-5-3-4-6-9(8)7-10(2)11/h3-7H,1-2H3
InChI Key:
SZCGVKIAFPQVOY-UHFFFAOYSA-N
SMILES:
[O-][N+](=Cc1ccccc1C)C
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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