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azepane-1-carbaldehyde

azepane-1-carbaldehyde

CAS: 25114-81-2

Formula: C7H13NO

SMILES: O=CN1CCCCCC1

IUPAC: azepane-1-carbaldehyde

InChI: InChI=1S/C7H13NO/c9-7-8-5-3-1-2-4-6-8/h7H,1-6H2

Composition: C (66.11%), H (10.30%), N (11.01%), O (12.58%)

Molar Mass: 127.187

Atom Count: 22

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 127.099714043
Formal Charge 0
FSP3 0.86
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey AIPVTTKYSPOWFO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.51
Topological Polar Surface Area 20.31
Polarizability 14.1
Ring Count 1
Rotatable Bond Count 0

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