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1,4-oxazepane hydrochloride

1,4-oxazepane hydrochloride

CAS: 178312-62-4

Formula: C5H12ClNO

SMILES: Cl.C1CNCCOC1

IUPAC: 1,4-oxazepane hydrochloride

InChI: InChI=1S/C5H11NO.ClH/c1-2-6-3-5-7-4-1;/h6H,1-5H2;1H

Composition: C (43.64%), H (8.79%), Cl (25.76%), N (10.18%), O (11.63%)

Molar Mass: 137.61

Atom Count: 20

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 137.0607417
Formal Charge 0
FSP3 1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LJRCWNIWOVZLKS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 28.63
Topological Polar Surface Area 21.26
Polarizability 11.43
Ring Count 1
Rotatable Bond Count 0

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