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tert-butyl N-[(3-fluoroazetidin-3-yl)methyl]-N-methylcarbamate hydrochloride

tert-butyl N-[(3-fluoroazetidin-3-yl)methyl]-N-methylcarbamate hydrochloride

CAS: 2231676-25-6

Formula: C10H20ClFN2O2

SMILES: Cl.CN(CC1(F)CNC1)C(=O)OC(C)(C)C

IUPAC: tert-butyl N-[(3-fluoroazetidin-3-yl)methyl]-N-methylcarbamate hydrochloride

InChI: InChI=1S/C10H19FN2O2.ClH/c1-9(2,3)15-8(14)13(4)7-10(11)5-12-6-10;/h12H,5-7H2,1-4H3;1H

Composition: C (47.15%), H (7.91%), Cl (13.92%), F (7.46%), N (11.00%), O (12.56%)

Molar Mass: 254.73

Atom Count: 36

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 254.1197338
Formal Charge 0
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JZTJYNHJMAETET-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.6
Topological Polar Surface Area 41.57
Polarizability 21.61
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 2231676-25-6 $306.42-$841.09$306.42$489.27$841.09
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