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Details

Stereochemistry ACHIRAL
Molecular Formula C5H12S
Molecular Weight 104.214
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PENTANETHIOL

SMILES

CCCCCS

InChI

InChIKey=ZRKMQKLGEQPLNS-UHFFFAOYSA-N
InChI=1S/C5H12S/c1-2-3-4-5-6/h6H,2-5H2,1H3

HIDE SMILES / InChI

Molecular Formula C5H12S
Molecular Weight 104.214
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Structure-activity relationships of (S,Z)-2-aminopurine methylenecyclopropane analogues of nucleosides. Variation of purine-6 substituents and activity against herpesviruses and hepatitis B virus.
2003 Apr 10
Transferable potentials for phase equilibria. 8. United-atom description for thiols, sulfides, disulfides, and thiophene.
2005 Dec 22
Chemical compounds that target thiol-disulfide groups on mononuclear phagocytes inhibit immune mediated phagocytosis of red blood cells.
2005 Mar
Impedance differences found with n-alkanethiol monolayers prepared by contact printing and solution adsorption.
2009 Aug 15
Solid-phase nano-extraction and laser-excited time-resolved Shpol'skii spectroscopy for the analysis of polycyclic aromatic hydrocarbons in drinking water samples.
2009 Feb 15
Organozirconium complexes as catalysts for Markovnikov-selective intermolecular hydrothiolation of terminal alkynes: scope and mechanism.
2010 Aug 4
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:10:52 GMT 2023
Edited
by admin
on Fri Dec 15 19:10:52 GMT 2023
Record UNII
9A3YK965F3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-PENTANETHIOL
FHFI  
Systematic Name English
1-PENTANETHIOL [FHFI]
Common Name English
PENTANETHIOL, 1-
Systematic Name English
N-AMYL MERCAPTAN [MI]
Common Name English
AMYL MERCAPTAN [HSDB]
Common Name English
N-AMYL MERCAPTAN
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 100701
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
JECFA EVALUATION 1-PENTANETHIOL
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
Code System Code Type Description
MERCK INDEX
m1874
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
203-789-1
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY
HSDB
468
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY
PUBCHEM
8067
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY
JECFA MONOGRAPH
1650
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY
CAS
110-66-7
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY
FDA UNII
9A3YK965F3
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID9041605
Created by admin on Fri Dec 15 19:10:52 GMT 2023 , Edited by admin on Fri Dec 15 19:10:52 GMT 2023
PRIMARY