3,6,9,12-tetraoxapentadec-14-yn-1-amine

3,6,9,12-tetraoxapentadec-14-yn-1-amine

CAS: 1013921-36-2

Formula: C11H21NO4

SMILES: NCCOCCOCCOCCOCC#C

IUPAC: 3,6,9,12-tetraoxapentadec-14-yn-1-amine

InChI: InChI=1S/C11H21NO4/c1-2-4-13-6-8-15-10-11-16-9-7-14-5-3-12/h1H,3-12H2

Composition: C (57.12%), H (9.15%), N (6.06%), O (27.67%)

Molar Mass: 231.292

Atom Count: 37

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	231.14705816
Formal Charge	0
FSP3	0.82
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	QDLPAHLHHBCWOW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.67
Topological Polar Surface Area	62.94
Polarizability	24.22
Ring Count	0
Rotatable Bond Count	12

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