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86209-99-6 | (E)-cyclopropylmethylidene-methyl-oxido-azanium
CAS No: 86209-99-6 Catalog No: AG004K2O MDL No:
Product Description
Catalog Number:
AG004K2O
Chemical Name:
(E)-cyclopropylmethylidene-methyl-oxido-azanium
CAS Number:
86209-99-6
Molecular Formula:
C5H9NO
Molecular Weight:
99.1311
IUPAC Name:
1-cyclopropyl-N-methylmethanimine oxide
InChI:
InChI=1S/C5H9NO/c1-6(7)4-5-2-3-5/h4-5H,2-3H2,1H3
InChI Key:
YWDOJNANUJWVCW-UHFFFAOYSA-N
SMILES:
[O-]/[N+](=C/C1CC1)/C
Properties
Complexity:
94.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.068g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
99.133g/mol
Monoisotopic Mass:
99.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.2
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