methyldipropylamine

• ChemBase ID: 10743
• Molecular Formular: C7H17N
• Molecular Mass: 115.21658
• Monoisotopic Mass: 115.13609955
• SMILES: N(C)(CCC)CCC
• Canonical SMILES: CCCN(CCC)C
• InChI: InChI=1S/C7H17N/c1-4-6-8(3)7-5-2/h4-7H2,1-3H3
• InChIKey: UVBMZKBIZUWTLV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyldipropylamine
• IUPAC Traditional name: methyldipropylamine
• Synonyms: N-Methyldipropylamine; METHYL di-n-PROPYLAMINE; N-Methyldipropylamine; N-甲基二丙胺

Database IDs

• CAS Number: 3405-42-3
• MDL Number: MFCD00048683
• PubChem SID: 24874049; 160974050
• PubChem CID: 559387

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -1.5321006
• LogD (pH = 7.4): -0.86882776
• Log P: 1.9488301
• Molar Refractivity: 38.5333 cm^3
• Polarizability: 15.189125 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 117 °C(lit.); 117°C
• Flash Point: 3 °C; 37.4 °F
• Density: 0.734 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.406(lit.)

Safety Information

• Storage Warning: CORROSIVE
• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 2924
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11-34
• Safety Statements: 16-26-36/37/39-45
• TSCA Listed: false
• GHS Pictograms: GHS02; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H314
• GHS Precautionary statements: P210-P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2924 3/PG 2

Product Information

• Purity: 98%
• Linear Formula: (CH3CH2CH2)2NCH3

DETAILS

MP Biomedicals - 05226335

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 518824

Packaging
10 g in glass bottle