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azetidine-3-carbonitrile hydrochloride

azetidine-3-carbonitrile hydrochloride

CAS: 345954-83-8

Formula: C4H7ClN2

SMILES: Cl.N#CC1CNC1

IUPAC: azetidine-3-carbonitrile hydrochloride

InChI: InChI=1S/C4H6N2.ClH/c5-1-4-2-6-3-4;/h4,6H,2-3H2;1H

Composition: C (40.52%), H (5.95%), Cl (29.90%), N (23.63%)

Molar Mass: 118.56

Atom Count: 14

Heavy Atom Count: 7

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 118.0297759
Formal Charge 0
FSP3 0.75
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey MJZQSPDYIKSJCN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 22.54
Topological Polar Surface Area 35.82
Polarizability 8.74
Ring Count 1
Rotatable Bond Count 0

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97% <7 Days 345954-83-8 $12.42-$166.64$12.42$20.70$46.58$86.94$166.64
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97% <6 Days 345954-83-8 $9.20-$127.65$9.20$16.10$33.35$59.80$127.65
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