2,4-diethylpentane-1,5-diol

2,4-diethylpentane-1,5-diol

CAS: 57987-55-0

Formula: C9H20O2

SMILES: CCC(CO)CC(CC)CO

IUPAC: 2,4-diethylpentane-1,5-diol

InChI: InChI=1/C9H20O2/c1-3-8(6-10)5-9(4-2)7-11/h8-11H,3-7H2,1-2H3

Composition: C (67.45%), H (12.58%), O (19.97%)

Molar Mass: 160.257

Atom Count: 31

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	160.146329884
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	OJRJDENLRJHEJO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.81
Topological Polar Surface Area	40.46
Polarizability	18.54
Ring Count	0
Rotatable Bond Count	6

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Purity	LeadTime	CAS		UnitPrice
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Frinton Laboratories, Inc.

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91%	<10 Days	57987-55-0		$49.50-$209.70$49.50$209.70

Liquid, (plus 8% isomer)

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