oxane-4-carbonyl chloride

oxane-4-carbonyl chloride

CAS: 40191-32-0

Formula: C6H9ClO2

SMILES: ClC(=O)C1CCOCC1

IUPAC: oxane-4-carbonyl chloride

InChI: InChI=1S/C6H9ClO2/c7-6(8)5-1-3-9-4-2-5/h5H,1-4H2

Composition: C (48.50%), H (6.11%), Cl (23.86%), O (21.54%)

Molar Mass: 148.59

Atom Count: 18

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	148.0291072
Formal Charge	0
FSP3	0.83
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RYGUCYSSMOFTSH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.25
Topological Polar Surface Area	26.3
Polarizability	13.76
Ring Count	1
Rotatable Bond Count	1

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