• ChemBase ID: 135324
• Molecular Formular: C2H7N
• Molecular Mass: 45.08368
• Monoisotopic Mass: 45.05784923
• SMILES: CNC
• Canonical SMILES: CNC
• InChI: InChI=1S/C2H7N/c1-3-2/h3H,1-2H3
• InChIKey: ROSDSFDQCJNGOL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• Synonyms: Dimethylamine-d7; 二甲胺-d7

Database IDs

• MDL Number: MFCD00144139
• PubChem SID: 162229598; 24881195
• PubChem CID: 16217387

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -3.427765
• LogD (pH = 7.4): -3.0703833
• Log P: -0.19287847
• Molar Refractivity: 14.6934 cm^3
• Polarizability: 5.9539757 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 7 °C(lit.)
• Flash Point: 21.2 °F; -6 °C
• Mass Shift: M+7

Safety Information

• European Hazard Symbols: Highly flammable (F+); Harmful (Xn)
• UN Number: 1032
• German water hazard class: 2
• Hazard Class: 2.1
• Risk Statements: 12-20-37/38-41
• Safety Statements: 16-26-39
• GHS Pictograms: GHS02; GHS04; GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H220-H280-H315-H318-H332-H335
• GHS Precautionary statements: P210-P261-P280-P305 + P351 + P338-P410 + P403
• RID/ADR: UN 1032 2.1

Product Information

• Isotopic Purity: 98 atom % D
• Mol. Weight: mol wt 89.43 by atom % calculation
• Linear Formula: (CD3)2ND

DETAILS

Sigma Aldrich - 587974

Packaging
Sure/Pac™ cylinder with SS 1/4" male NPT valve
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
Recommended products
Stainless steel hose adapter Z14,683-8 or stainless steel body mini gas regulator Z51,354-7 is recommended.
Legal Information
Sure/Pac is a trademark of Sigma-Aldrich Co. LLC