2-Butyl-1-octanol
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2-Butyl-1-octanol
structure -
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CAS No:
3913-02-8
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Formula:
C12H26O
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Chemical Name:
2-Butyl-1-octanol
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Synonyms:
1-Octanol,2-butyl-;2-Butyl-1-octanol;2-Butyloctyl alcohol;2-Butyloctanol;5-(Hydroxymethyl)undecane;Isofol 12;Jarcol I 12;NSC 2414;Guerbet C12;Guerbet dodecanol;Butyloctanol;Butyloctyl alcohol;201057-93-4
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CAS No:
Description
liquid
Liquid
2-butyl-1-octanol is a primary alcohol that is 1-octanol substituted by a butyl group at position 2. Metabolite observed in cancer metabolism. It has a role as a human metabolite. It is a primary alcohol, a fatty alcohol and an alkyl alcohol. It derives from a hydride of an octane.
Characteristics
20.23000
3.75550
Liquid
0.8371 g/cm3 @ Temp: 16.5 °C
< -30ºC
132 °C
110ºC
1.439
16.18 mg/L @ 25 °C (est)
Safety Information
UN 3082 9 / PGIII
2
57-61
RH0885000
N
Stable. Incompatible with strong oxidizing agents. Combustible.
P273
H400-H411
|Warning|H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]|P273, P391, and P501|Aggregated GHS information provided by 132 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-Butyl-1-octanol Use and Manufacturing
Intermediates
Cleaning and furnishing care products
500,000 - 1,000,000 lb
All other basic organic chemical manufacturing|1-Octanol, 2-butyl-: ACTIVE
Fatty Acyls [FA] -> Fatty alcohols [FA05]|Cosmetics -> Humectant
Computed Properties
Molecular Weight:186.33
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:9
Exact Mass:186.198365449
Monoisotopic Mass:186.198365449
Topological Polar Surface Area:20.2
Heavy Atom Count:13
Complexity:91.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 2-Butyl-1-octanol
-
CN
5 YRS
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CN
1 YR
Business licensedTrader Supplier of Pharmaceutical intermediatesInquiryCAS No.: 3913-02-8Grade: Industrial GradeContent: 97% -
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5 YRS
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