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287-92-3 molecular structure
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cyclopentane

ChemBase ID: 103148
Molecular Formular: C5H10
Molecular Mass: 70.1329
Monoisotopic Mass: 70.07825032
SMILES and InChIs

SMILES:
C1CCCC1
Canonical SMILES:
C1CCCC1
InChI:
InChI=1S/C5H10/c1-2-4-5-3-1/h1-5H2
InChIKey:
RGSFGYAAUTVSQA-UHFFFAOYSA-N

Cite this record

CBID:103148 http://www.chembase.cn/molecule-103148.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
cyclopentane
IUPAC Traditional name
cyclopentane
cyclopentamin
Synonyms
pentamethylene
Cyclopentane, HPLC Grade
CYCLOPENTANE
CYCLOPENTANE 75%, CERTIFIED GRADE
Cyclopentane
环戊烷, HPLC级
环戊烷
CAS Number
287-92-3
EC Number
206-016-6
MDL Number
MFCD00001356
Beilstein Number
1900195
Merck Index
142741
PubChem SID
24857877
24869595
24857286
24856383
162090623
PubChem CID
9253
CHEBI ID
23492
Chemspider ID
8896
Wikipedia Title
Cyclopentane

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.2228434  LogD (pH = 7.4) 2.2228434 
Log P 2.2228434  Molar Refractivity 23.005 cm3
Polarizability 9.23521 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
clear, colorless liquid expand Show data source
Liquid expand Show data source
Melting Point
-93 °C (-135 °F) expand Show data source
-94 °C expand Show data source
-94 °C(lit.) expand Show data source
-95°C expand Show data source
Boiling Point
47-49°C expand Show data source
49°C expand Show data source
49.5 °C (121 °F) expand Show data source
50 °C(lit.) expand Show data source
Flash Point
-20 °C expand Show data source
-37°C(-34°F) expand Show data source
-4 °F expand Show data source
Auto Ignition Point
361 °C (682 °F) expand Show data source
682 °F expand Show data source
Density
0.748 expand Show data source
0.75 at 20 °C (water = 1) expand Show data source
0.751 g/cm3 expand Show data source
0.751 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4060 expand Show data source
n20/D 1.402 expand Show data source
n20/D 1.404 expand Show data source
n20/D 1.405(lit.) expand Show data source
n20/D 1.406 expand Show data source
Vapor Pressure
17.74 psi ( 55 °C) expand Show data source
17.85 psi ( 55 °C) expand Show data source
18.35 psi ( 55 °C) expand Show data source
18.93 psi ( 55 °C) expand Show data source
317.8 mm Hg at 25 °C., 400 mm Hg at 31 °C expand Show data source
5.09 psi ( 20 °C) expand Show data source
5.12 psi ( 20 °C) expand Show data source
5.3 psi ( 21 °C) expand Show data source
5.32 psi ( 20 °C) expand Show data source
5.67 psi ( 20 °C) expand Show data source
9.9 psi ( 38 °C) expand Show data source
Vapor Density
~2 (vs air) expand Show data source
2.4 (air = 1) expand Show data source
Absorption Wavelength
λ: 198 nm Amax: 1.0 expand Show data source
λ: 200 nm Amax: 1.0 expand Show data source
λ: 210 nm Amax: 0.50 expand Show data source
λ: 220 nm Amax: 0.1 expand Show data source
λ: 220 nm Amax: 0.10 expand Show data source
λ: 240 nm Amax: 0.01 expand Show data source
λ: 240-400 nm Amax: 0.01 expand Show data source
pKa
~45 expand Show data source
Storage Condition
2-8°C expand Show data source
RTECS
GY2390000 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
UN Number
1146 expand Show data source
UN1146 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
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Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Australian Hazchem
3YE expand Show data source
Risk Statements
11-52/53 expand Show data source
R:11-52/53 expand Show data source
Safety Statements
9-16-29-33-61 expand Show data source
S:9-16-29-33-61 expand Show data source
EU Classification
F1 expand Show data source
EU Hazard Identification Number
3B expand Show data source
Emergency Response Guidebook(ERG) Number
128 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS Signal Word
Danger expand Show data source
Explode Limits
8.7 % expand Show data source
GHS Hazard statements
H225-H412 expand Show data source
GHS Precautionary statements
P210-P241-P280-P303+P361+P353-P403+P235-P501A expand Show data source
P210-P273 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US) expand Show data source
RID/ADR
UN 1146 3/PG 2 expand Show data source
Purity
>75% cyclopentane basis expand Show data source
≥75% (GC) expand Show data source
≥75% cyclopentane basis expand Show data source
≥97.0% (GC) expand Show data source
≥98% cyclopentane and saturated C5 hydrocarbons basis expand Show data source
≥98.5% (GC) expand Show data source
≥99.0% (GC) expand Show data source
75% expand Show data source
95% expand Show data source
97% expand Show data source
98% expand Show data source
Grade
analytical standard expand Show data source
analytical standard, for environmental analysis expand Show data source
anhydrous expand Show data source
B&J Brand (product of Burdick & Jackson) expand Show data source
CHROMASOLV® expand Show data source
for HPLC expand Show data source
purum expand Show data source
reagent grade expand Show data source
technical expand Show data source
Certificate of Analysis
Download expand Show data source
Download expand Show data source
Download expand Show data source
Evaporation Residue
<0.0003% expand Show data source
≤0.001% expand Show data source
Impurities
≤0.02% water expand Show data source
≤2% 2,2-dimethyl-butane expand Show data source
≥75% cyclopentane expand Show data source
2,2-dimethyl-butane expand Show data source
C5 and C6 saturated hydrocarbons, balance expand Show data source
cyclopentene expand Show data source
Shelf Life
(limited shelf life, expiry date on the label) expand Show data source
λ
1 cm path, H2O reference expand Show data source
H2O reference expand Show data source
Empirical Formula (Hill Notation)
C5H10 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
MP Biomedicals - 02150747 external link
Purity: 97%
1 ml = approx. 0.75 g
MP Biomedicals - 05214149 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - C111805 external link
Packaging
500 mL in glass bottle
Sigma Aldrich - 29686 external link
General description
Special brochure (85475) available at cost price.
Other Notes
Sales restrictions may apply
Sigma Aldrich - 459747 external link
Packaging
100, 500 mL in glass bottle
2 L in glass bottle
Legal Information
ReagentPlus is a registered trademark of Sigma-Aldrich Co. LLC
Sigma Aldrich - 287687 external link
Other Notes
remainder C5 and C6 hydrocarbons
Sigma Aldrich - 270601 external link
Packaging
1, 2 L in glass bottle
Preparation Note
Glass distilled
Legal Information
CHROMASOLV is a registered trademark of Sigma-Aldrich Laborchemikalien GmbH

REFERENCES

REFERENCES

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PATENTS

PATENTS

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