Benzo-18-crown 6-Ether

Catalog Number	ACM14098249-2
CAS	14098-24-9
Structure
Synonyms	2,3-Benzo-1,4,7,10,13,16-hexaoxaoctadec-2-ene
IUPAC Name	2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene
Molecular Weight	312.36
Molecular Formula	C16H24O6
Canonical SMILES	C1COCCOCCOC2=CC=CC=C2OCCOCCO1
InChI	DSFHXKRFDFROER-UHFFFAOYSA-N
InChI Key	InChI=1S/C16H24O6/c1-2-4-16-15(3-1)21-13-11-19-9-7-17-5-6-18-8-10-20-12-14-22-16/h1-4H,5-14H2
Boiling Point	451.8 °C at 760 mmHg
Melting Point	42-45 °C(lit.)
Flash Point	113 °C
Purity	96%
Appearance	White powder
Complexity	237
Covalently-Bonded Unit Count	1
Exact Mass	312.157288g/mol
Formal Charge	0
Heavy Atom Count	22
Isomeric SMILES	C1COCCOCCOC2=CC=CC=C2OCCOCCO1
Monoisotopic Mass	312.157288g/mol
Rotatable Bond Count	0