1-Iodooctadecane

• CAS: 629-93-6
• Catalog Number: ACM629936
• Category: Alkyl
• Molecular Weight: 380.4g/mol
• Molecular Formula: C18H37I
• IUPAC Name: 1-iodooctadecane
• Canonical SMILES: CCCCCCCCCCCCCCCCCCI
• InChI: InChI=1S/C18H37I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-18H2,1H3
• InChI Key: ZNJOCVLVYVOUGB-UHFFFAOYSA-N
• Boiling Point: 383.0 °C
• Melting Point: 34.0 °C
• Complexity: 145
• Covalently-Bonded Unit Count: 1
• EC Number: 211-117-3
• Exact Mass: 380.194g/mol
• Formal Charge: 0
• Hazard Statements: H315-H319-H335
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 19
• Monoisotopic Mass: 380.194g/mol
• NSC Number: 5544
• RIDADR: NONH for all modes of transport
• Rotatable Bond Count: 16
• Symbol: GHS07
• Vapor Pressure: 1.92e-06 mmHg
• XLogP3: 10.7

Custom Q&A

What is the molecular formula of 1-Iodooctadecane?

The molecular formula of 1-Iodooctadecane is C18H37I.

What is the molecular weight of 1-Iodooctadecane?

The molecular weight of 1-Iodooctadecane is 380.4 g/mol.

What is the IUPAC Name of 1-Iodooctadecane?

The IUPAC Name of 1-Iodooctadecane is 1-iodooctadecane.

What is the InChI of 1-Iodooctadecane?

The InChI of 1-Iodooctadecane is InChI=1S/C18H37I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-18H2,1H3.

What is the InChIKey of 1-Iodooctadecane?

The InChIKey of 1-Iodooctadecane is ZNJOCVLVYVOUGB-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Iodooctadecane?

The canonical SMILES of 1-Iodooctadecane is CCCCCCCCCCCCCCCCCCI.

What is the CAS number of 1-Iodooctadecane?

The CAS number of 1-Iodooctadecane is 629-93-6.

What is the XLogP3 value of 1-Iodooctadecane?

The XLogP3 value of 1-Iodooctadecane is 10.7.

How many rotatable bonds does 1-Iodooctadecane have?

1-Iodooctadecane has 16 rotatable bonds.

Is 1-Iodooctadecane a canonicalized compound?

Yes, 1-Iodooctadecane is a canonicalized compound.