(2-methoxy-2-oxoethyl)(methylidyne)azanium

(2-methoxy-2-oxoethyl)(methylidyne)azanium

CAS: 39687-95-1

Formula: C4H6NO2

SMILES: COC(=O)C[N+]#C

IUPAC: (2-methoxy-2-oxoethyl)(methylidyne)azanium

InChI: InChI=1S/C4H6NO2/c1-5-3-4(6)7-2/h1H,3H2,2H3/q+1

Composition: C (48.00%), H (6.04%), N (13.99%), O (31.97%)

Molar Mass: 100.096

Atom Count: 13

Heavy Atom Count: 7

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	100.039304857
Formal Charge	1
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	GOYOBRBLPDRRML-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	23.56
Topological Polar Surface Area	30.66
Polarizability	9.23
Ring Count	0
Rotatable Bond Count	2

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