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ethyl 3-(dibenzylamino)-2,2-difluoropropanoate

ethyl 3-(dibenzylamino)-2,2-difluoropropanoate

CAS: 541547-36-8

Formula: C19H21F2NO2

SMILES: CCOC(=O)C(F)(F)CN(CC1=CC=CC=C1)CC1=CC=CC=C1

IUPAC: ethyl 3-(dibenzylamino)-2,2-difluoropropanoate

InChI: InChI=1S/C19H21F2NO2/c1-2-24-18(23)19(20,21)15-22(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3

Composition: C (68.45%), H (6.35%), F (11.40%), N (4.20%), O (9.60%)

Molar Mass: 333.379

Atom Count: 45

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 333.154035246
Formal Charge 0
FSP3 0.32
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey VZBXWYDVDVKRLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.63
Topological Polar Surface Area 29.54
Polarizability 34.49
Ring Count 2
Rotatable Bond Count 9

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