1-tert-butyl 8-methyl octanedioate

1-tert-butyl 8-methyl octanedioate

CAS: 137299-08-2

Formula: C13H24O4

SMILES: COC(=O)CCCCCCC(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 8-methyl octanedioate

InChI: InChI=1S/C13H24O4/c1-13(2,3)17-12(15)10-8-6-5-7-9-11(14)16-4/h5-10H2,1-4H3

Composition: C (63.91%), H (9.90%), O (26.19%)

Molar Mass: 244.331

Atom Count: 41

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	244.167459253
Formal Charge	0
FSP3	0.85
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	AVMXBOOJSVOCFZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.28
Topological Polar Surface Area	52.6
Polarizability	26.22
Ring Count	0
Rotatable Bond Count	10

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