(±)-2-Ethyl-1-octanol - CAS 20592-10-3

Name: (±)-2-Ethyl-1-octanol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB055999
Product Name:	(±)-2-Ethyl-1-octanol
CAS:	20592-10-3
Synonyms:	2-Ethyloctan-1-ol; 2-ethyl-1-octanol; (-)-2-ethyl-1-octanol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-ethyloctan-1-ol
Description:	(±)-2-Ethyl-1-octanol is used in the synthesis of biogasoline from ethanol over hydroxyapatite catalyst.
Molecular Weight:	158.28
Molecular Formula:	C10H22O
Canonical SMILES:	CCCCCCC(CC)CO
InChI:	InChI=1S/C10H22O/c1-3-5-6-7-8-10(4-2)9-11/h10-11H,3-9H2,1-2H3
InChI Key:	HTRVTKUOKQWGMO-UHFFFAOYSA-N

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Related Functional Groups

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

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Complexity:	71.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.167065321
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	158.167065321
Rotatable Bond Count:	7
Topological Polar Surface Area:	20.2Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.8