cyclopropanamine

• ChemBase ID: 9948
• Molecular Formular: C3H7N
• Molecular Mass: 57.09438
• Monoisotopic Mass: 57.05784923
• SMILES: C1CC1N
• Canonical SMILES: NC1CC1
• InChI: InChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2
• InChIKey: HTJDQJBWANPRPF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cyclopropanamine
• IUPAC Traditional name: aminocyclopropane
• Synonyms: Cyclopropylamine; cyclopropanamine; Cyclopropylamine; Aminocyclopropane; Cyclopropylamine 98%; 氨基环丙烷; 环丙胺

Database IDs

• CAS Number: 765-30-0
• EC Number: 212-142-2
• MDL Number: MFCD00001301
• Beilstein Number: 741858
• PubChem SID: 160973255; 24858041; 24847670
• PubChem CID: 69828

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -3.1803057
• LogD (pH = 7.4): -2.6675591
• Log P: -0.15989433
• Molar Refractivity: 17.13 cm^3
• Polarizability: 7.059403 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -10°C; -10°C
• Boiling Point: 48-50°C; 49-50 °C(lit.); 49-50°C; 49-50°C
• Flash Point: 1 °C; -14.8 °F; -25°C; -25°C(-13°F); -26 °C; 33.8 °F
• Auto Ignition Point: 527 °F
• Density: 0.824; 0.824 g/mL at 25 °C(lit.)
• Refractive Index: 1.4206; n20/D 1.420; n20/D 1.420(lit.)
• Vapor Pressure: 4.67 psi ( 20 °C)

Safety Information

• Storage Warning: Highly Flammable/Corrosive/Harmful/Lachrymatory/Hygroscopic/Store under Argon; Hygroscopic; IRRITANT, FLAMMABLE, CORROSIVE
• RTECS: GZ0685500
• European Hazard Symbols: Corrosive (C); Flammable (F); X
• UN Number: 2733; UN2733
• German water hazard class: 2; 3
• Hazard Class: 3
• Packing Group: 2; II
• Risk Statements: 11-22-34
• Safety Statements: 16-26-36/37/39-45; 9-16-20-23-26-36/37/39-45
• TSCA Listed: true; 是
• GHS Pictograms: GHS02; GHS05; GHS06; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H301-H314-H318; H225-H302-H314
• GHS Precautionary statements: P210-P280-P305 + P351 + P338-P310; 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)
• RID/ADR: UN 2733 3/PG 2

Product Information

• Purity: ≥98.0% (GC); 97%; 98%; 98+%; 99%
• Grade: purum
• Impurities: ≤1% water
• Linear Formula: C3H5NH2

DETAILS

Sigma Aldrich - 125504

Packaging
10, 25 g in ampule