Decylcyclopentane
PubChem CID
137211
Structure
Molecular Formula
Synonyms
- Decylcyclopentane
- Cyclopentane, decyl-
- 1795-21-7
- Decane, 1-cyclopentyl-
- n-Decylcyclopentane
Molecular Weight
210.40 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Dates
- Create:2005-03-26
- Modify:2025-01-18
Chemical Structure Depiction
decylcyclopentane
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C15H30/c1-2-3-4-5-6-7-8-9-12-15-13-10-11-14-15/h15H,2-14H2,1H3
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
WOUVLFFZQCUYOL-UHFFFAOYSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
CCCCCCCCCCC1CCCC1
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C15H30
Computed by PubChem 2.2 (PubChem release 2021.10.14)
1795-21-7
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
210.40 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
XLogP3-AA
Property Value
7.8
Reference
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
0
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
9
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
210.234750957 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
210.234750957 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
0 Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
15
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
122
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
Standard non-polar
1536.3 , 1550
Other Classes -> Aliphatics, Saturated (>C11)
NIST Number
118900
Library
Main library
Total Peaks
81
m/z Top Peak
69
m/z 2nd Highest
41
m/z 3rd Highest
68
Thumbnail
NIST Number
9652
Library
Replicate library
Total Peaks
105
m/z Top Peak
41
m/z 2nd Highest
69
m/z 3rd Highest
68
Thumbnail
Follow these links to do a live 2D search or do a live 3D search for this compound, sorted by annotation score. This section is deprecated (see here for details), but these live search links provide equivalent functionality to the table that was previously shown here.
Same Parent, Exact Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
See Methylcyclopentane.
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=WOUVLFFZQCUYOL-UHFFFAOYSA-N
- ChemIDplusCyclopentane, decyl-https://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0001795217ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- DTP/NCILICENSEUnless otherwise indicated, all text within NCI products is free of copyright and may be reused without our permission. Credit the National Cancer Institute as the source.https://www.cancer.gov/policies/copyright-reuse
- EPA DSSToxCyclopentane, decyl-https://comptox.epa.gov/dashboard/DTXSID6074700CompTox Chemicals Dashboard Chemical Listshttps://comptox.epa.gov/dashboard/chemical-lists/
- Haz-Map, Information on Hazardous Chemicals and Occupational DiseasesLICENSECopyright (c) 2022 Haz-Map(R). All rights reserved. Unless otherwise indicated, all materials from Haz-Map are copyrighted by Haz-Map(R). No part of these materials, either text or image may be used for any purpose other than for personal use. Therefore, reproduction, modification, storage in a retrieval system or retransmission, in any form or by any means, electronic, mechanical or otherwise, for reasons other than personal use, is strictly prohibited without prior written permission.https://haz-map.com/AboutDecylcyclopentanehttps://haz-map.com/Agents/13509
- Japan Chemical Substance Dictionary (Nikkaji)
- NIST Mass Spectrometry Data CenterLICENSEData covered by the Standard Reference Data Act of 1968 as amended.https://www.nist.gov/srd/public-lawCyclopentane, decyl-http://www.nist.gov/srd/nist1a.cfm
- SpectraBaseCyclopentane, decyl-https://spectrabase.com/spectrum/4dR0fUUNs3fCyclopentane, decyl-https://spectrabase.com/spectrum/B16XTcByAtv1-CYCLOPENTYLDECANEhttps://spectrabase.com/spectrum/JuFvsXZjOg7
- Springer Nature
- SpringerMaterials
- WikidataCyclopentane, decyl-https://www.wikidata.org/wiki/Q82002943
- PubChem
- GHS Classification (UNECE)GHS Classification Treehttp://www.unece.org/trans/danger/publi/ghs/ghs_welcome_e.html
- NORMAN Suspect List ExchangeLICENSEData: CC-BY 4.0; Code (hosted by ECI, LCSB): Artistic-2.0https://creativecommons.org/licenses/by/4.0/NORMAN Suspect List Exchange Classificationhttps://www.norman-network.com/nds/SLE/
- EPA Substance Registry ServicesEPA SRS List Classificationhttps://sor.epa.gov/sor_internet/registry/substreg/LandingPage.do
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
- PATENTSCOPE (WIPO)SID 388644708https://pubchem.ncbi.nlm.nih.gov/substance/388644708
CONTENTS