2-methyl-1,4-oxazepane

2-methyl-1,4-oxazepane

CAS: 1018614-41-9

Formula: C6H13NO

SMILES: CC1CNCCCO1

IUPAC: 2-methyl-1,4-oxazepane

InChI: InChI=1/C6H13NO/c1-6-5-7-3-2-4-8-6/h6-7H,2-5H2,1H3

Composition: C (62.57%), H (11.38%), N (12.16%), O (13.89%)

Molar Mass: 115.176

Atom Count: 21

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	115.099714043
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HQKJQSCCAMQSPY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.05
Topological Polar Surface Area	21.26
Polarizability	13.27
Ring Count	1
Rotatable Bond Count	0

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