2-PENTANOL

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C5H12O
Molecular Weight	88.1482
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-PENTANOL

SMILES

CCCC(C)O

InChI

InChIKey=JYVLIDXNZAXMDK-UHFFFAOYSA-N

InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C5H12O
Molecular Weight	88.1482
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

Show entries

Title	Date	PubMed
[Determination of major flavor components in chinese spirits using a special domestic gas chromatograph with DNP packed column].	2002 Sep	16358707
Microemulsion electrokinetic chromatography for the analysis of green tea catechins: effect of the cosurfactant on the separation selectivity.	2003 May	12761797
The contribution of tunnelling to the 1,5 H-shift isomerisation reaction of alkoxyl radicals.	2008 Feb 21	18259635
Characterization and utilization of a novel triflate ionic liquid stationary phase for use in comprehensive two-dimensional gas chromatography.	2008 Oct	18798215
Relationship between selected indoor volatile organic compounds, so-called microbial VOC, and the prevalence of mucous membrane symptoms in single family homes.	2010 Apr 15	20188399

Showing 1 to 5 of 8 entries

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Patents

Substance Class	Chemical
Record UNII	04G7050365
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

2-PENTANOL

Systematic Name

English

SEC-AMYL ALCOHOL

Common Name

English

2-PENTANOL [MI]

Common Name

English

SEC-PENTYL ALCOHOL

Systematic Name

English

2-HYDROXYPENTANE

Systematic Name

English

Showing 1 to 5 of 14 entries

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Show entries

Classification Tree

Code System

Code

FUNCTIONAL CLASSIFICATION

JECFA EVALUATION

2-PENTANOL

Showing 1 to 1 of 1 entries

Show entries

Code System

Code

Type

Description

ECHA (EC/EINECS)

227-907-6

PRIMARY

CHEBI

77519

PRIMARY

PUBCHEM

22386

PRIMARY

WIKIPEDIA

2-PENTANOL

PRIMARY

FDA UNII

04G7050365

PRIMARY

Showing 1 to 5 of 10 entries

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