2,6-dibutyl naphthalene-2,6-dicarboxylate

2,6-dibutyl naphthalene-2,6-dicarboxylate

CAS: 94686-82-5

Formula: C20H24O4

SMILES: CCCCOC(=O)C1=CC2=CC=C(C=C2C=C1)C(=O)OCCCC

IUPAC: 2,6-dibutyl naphthalene-2,6-dicarboxylate

InChI: InChI=1S/C20H24O4/c1-3-5-11-23-19(21)17-9-7-16-14-18(10-8-15(16)13-17)20(22)24-12-6-4-2/h7-10,13-14H,3-6,11-12H2,1-2H3

Composition: C (73.15%), H (7.37%), O (19.49%)

Molar Mass: 328.408

Atom Count: 48

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	328.167459253
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	PCFNKFGGJYQMTR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	94.31
Topological Polar Surface Area	52.6
Polarizability	37.73
Ring Count	2
Rotatable Bond Count	10

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