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1003-03-8 molecular structure
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cyclopentanamine

ChemBase ID: 69509
Molecular Formular: C5H11N
Molecular Mass: 85.14754
Monoisotopic Mass: 85.08914936
SMILES and InChIs

SMILES:
NC1CCCC1
Canonical SMILES:
NC1CCCC1
InChI:
InChI=1S/C5H11N/c6-5-3-1-2-4-5/h5H,1-4,6H2
InChIKey:
NISGSNTVMOOSJQ-UHFFFAOYSA-N

Cite this record

CBID:69509 http://www.chembase.cn/molecule-69509.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
cyclopentanamine
IUPAC Traditional name
cyclopentanamine
Synonyms
Aminocyclopentane
Cyclopentylamine
AMINOCYCLOPENTANE
Cyclopentylamine
氨基环戊烷
环戊胺
CAS Number
1003-03-8
EC Number
213-697-3
MDL Number
MFCD00001380
Beilstein Number
635706
PubChem SID
162035235
24892364
PubChem CID
2906

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.2987092  LogD (pH = 7.4) -2.0139537 
Log P 0.729243  Molar Refractivity 26.332 cm3
Polarizability 10.75224 Å3 Polar Surface Area 26.02 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
-85°C expand Show data source
Boiling Point
106-108 °C(lit.) expand Show data source
106-108°C expand Show data source
106-108°C expand Show data source
Flash Point
12°C(53°F) expand Show data source
13 °C expand Show data source
13°C expand Show data source
55.4 °F expand Show data source
Density
0.862 expand Show data source
0.863 expand Show data source
0.863 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4505 expand Show data source
n20/D 1.450(lit.) expand Show data source
Storage Warning
Highly/Flammable/Toxic expand Show data source
IRRITANT expand Show data source
RTECS
GY8452000 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
3286 expand Show data source
UN3286 expand Show data source
MSDS Link
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
Risk Statements
11-20-25-34-43 expand Show data source
Safety Statements
16-26-36/37/39-45 expand Show data source
TSCA Listed
false expand Show data source
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS05 expand Show data source
GHS06 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H225-H300-H315-H317-H318-H332 expand Show data source
H225-H300-H331-H317-H314-H318 expand Show data source
GHS Precautionary statements
P210-P264-P280-P301 + P310-P305 + P351 + P338 expand Show data source
P210-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 3286 3/PG 2 expand Show data source
Purity
95+% expand Show data source
98% expand Show data source
99% expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
C5H9NH2 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05209128 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - C115002 external link
Packaging
25, 100 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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