dibutyl (3-chloro-4-methyl-2-oxochromen-7-yl) phosphate

CAS: 14663-66-2

Molecular Formula	`C18H24ClO6P`
Molecular Weight	402.8 g/mol
LogP	4.6
Topological Polar Surface Area	71.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	402.0999
Heavy Atoms	26
Complexity	550.0

Chemical Identifiers

CAS Number	14663-66-2
SMILES	`CCCCOP(=O)(OCCCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C`
InChIKey	`MZJWBPPRJLFUOG-UHFFFAOYSA-N`

📖 Product Overview

dibutyl (3-chloro-4-methyl-2-oxochromen-7-yl) phosphate (CAS: 14663-66-2) is a chemical compound with molecular formula C18H24ClO6P and molecular weight 402.8 g/mol. Its IUPAC systematic name is dibutyl (3-chloro-4-methyl-2-oxochromen-7-yl) phosphate. LogP 4.6 Topological Polar Surface Area 71.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 10 Exact Mass 402.0999 Heavy Atoms 26 Complexity 550.0 InChI Key: MZJWBPPRJLFUOG-UHFFFAOYSA-N. SMILES: CCCCOP(=O)(OCCCC)OC1=CC2=C(C=C1)C(=C(C(=O)O2)Cl)C.

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