cyclopentanamine

• ChemBase ID: 69509
• Molecular Formular: C5H11N
• Molecular Mass: 85.14754
• Monoisotopic Mass: 85.08914936
• SMILES: NC1CCCC1
• Canonical SMILES: NC1CCCC1
• InChI: InChI=1S/C5H11N/c6-5-3-1-2-4-5/h5H,1-4,6H2
• InChIKey: NISGSNTVMOOSJQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cyclopentanamine
• IUPAC Traditional name: cyclopentanamine
• Synonyms: Aminocyclopentane; Cyclopentylamine; AMINOCYCLOPENTANE; Cyclopentylamine; 氨基环戊烷; 环戊胺

Database IDs

• 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

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.2987092
• LogD (pH = 7.4): -2.0139537
• Log P: 0.729243
• Molar Refractivity: 26.332 cm^3
• Polarizability: 10.75224 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -85°C
• Boiling Point: 106-108 °C(lit.); 106-108°C; 106-108°C
• Flash Point: 12°C(53°F); 13 °C; 13°C; 55.4 °F
• Density: 0.862; 0.863; 0.863 g/mL at 25 °C(lit.)
• Refractive Index: 1.4505; n20/D 1.450(lit.)

Safety Information

• Storage Warning: Highly/Flammable/Toxic; IRRITANT
• RTECS: GY8452000
• European Hazard Symbols: Flammable (F); Toxic (T)
• UN Number: 3286; UN3286
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2; II
• Risk Statements: 11-20-25-34-43
• Safety Statements: 16-26-36/37/39-45
• TSCA Listed: false; 是
• GHS Pictograms: GHS02; GHS05; GHS06
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H300-H315-H317-H318-H332; H225-H300-H331-H317-H314-H318
• GHS Precautionary statements: P210-P264-P280-P301 + P310-P305 + P351 + P338; P210-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3286 3/PG 2

Product Information

• Purity: 95+%; 98%; 99%
• Linear Formula: C5H9NH2

DETAILS

MP Biomedicals - 05209128

MP Biomedicals Rare Chemical collection

Sigma Aldrich - C115002

Packaging
25, 100 g in glass bottle