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5-(azidomethyl)-3,3-difluorooxolan-2-one

5-(azidomethyl)-3,3-difluorooxolan-2-one

CAS: 189136-13-8

Formula: C5H5F2N3O2

SMILES: FC1(F)CC(CN=[N+]=[N-])OC1=O

IUPAC: 5-(azidomethyl)-3,3-difluorooxolan-2-one

InChI: InChI=1/C5H5F2N3O2/c6-5(7)1-3(2-9-10-8)12-4(5)11/h3H,1-2H2

Composition: C (33.91%), H (2.85%), F (21.45%), N (23.73%), O (18.07%)

Molar Mass: 177.111

Atom Count: 17

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 177.034982739
Formal Charge 0
FSP3 0.8
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey DZMHURFSQZAGKK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 32.38
Topological Polar Surface Area 55.73
Polarizability 12.26
Ring Count 1
Rotatable Bond Count 2

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Shanghai AQ BioPharma Co., Ltd.
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Purity LeadTime CAS PacketSize UnitPrice
95% <8 Days 189136-13-8 $1,408.57-$6,761.14$1,408.57$4,225.71$6,761.14$12,677.14$20,283.43
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