3-Methoxypropionitrile

• CAS: 110-67-8
• Catalog Number: ACM110678
• Category: Other Products
• Molecular Weight: 85.11
• Molecular Formula: C4H7NO
• IUPAC Name: 3-methoxypropanenitrile
• Canonical SMILES: COCCC#N
• InChI: InChI=1S/C4H7NO/c1-6-4-2-3-5/h2,4H2,1H3
• InChI Key: OOWFYDWAMOKVSF-UHFFFAOYSA-N
• Boiling Point: 166 °C
• Melting Point: -63 °C
• Flash Point: 65 °C
• Appearance: Colorless to Almost colorless clear liquid
• Storage: Store under inert gas
• Complexity: 61.2
• Condition To Avoid: Hygroscopic
• Covalently-Bonded Unit Count: 1
• EC Number: 203-790-7
• Exact Mass: 85.052764g/mol
• Formal Charge: 0
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.H227 : Combustible liquid.
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 6
• MDL Number: MFCD00001958
• Monoisotopic Mass: 85.052764g/mol
• NSC Number: 61486;4090
• Precautionary Statements: P501 : Dispose of contents/ container to an approved waste disposal plant.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P403 + P235 : Store in a well-ventilated place. Keep cool.
• Refractive Index: 1.40
• Rotatable Bond Count: 2
• Signal Word: Warning
• Specific Gravity: 0.94
• XLogP3: -0.2