CCOC(OCC)P(=O)(CC(C[N+](=O)[O-])c1ccc(Cl)cc1)OCC
Name: ethyl 2-(4-chlorophenyl)-3-nitropropyl-(diethoxymethyl)phosphinate
SMILES: CCOC(OCC)P(=O)(CC(C[N+](=O)[O-])c1ccc(Cl)cc1)OCC

Molecular Processing

Molecular formula
C16H25ClNO6P
Molecular weight
393.8
Exact mass
393.1108
XLogP
4.37
TPSA
87.9
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
12
Heavy atoms
25
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
97.19

Supplementary Information

Details werden geladen…

An 12 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→