1,3-Bis(isocyanatomethyl)cyclohexane

• Catalog Number: ACM38661722-3
• Product Name: 1,3-Bis(isocyanatomethyl)cyclohexane
• CAS: 38661-72-2
• Category: Polymer/Macromolecule
• Synonyms: Hydrogenated m -xylylene diisocyanate, 1,3-Bis(methylisocyanate)cyclohexane
• Molecular Weight: 194.23
• Molecular Formula: C6H10(CH2NCO)2
• Canonical SMILES: O=C=NCC1CCCC(CN=C=O)C1
• InChI: 1S/C10H14N2O2/c13-7-11-5-9-2-1-3-10(4-9)6-12-8-14/h9-10H,1-6H2
• InChI Key: XSCLFFBWRKTMTE-UHFFFAOYSA-N
• Density: 1.101 g/mL at 25 °C (lit.)
• Application: This product is suitable for scientific research.
• Assay: 99%
• Features And Benefits: 1. High quality products; 2. Fast delivery; 3. Additional products can be ordered, please contact us for details
• MDL Number: MFCD00129947
• NACRES: NA.23
• PubChem ID: 24865341
• Quality Level: 200
• Refractive Index: n20/D 1.485 (lit.)
• Vapor Pressure: 0.4 mmHg ( 98 °C)

Custom Q&A

What is the molecular formula of 1,3-Bis(isocyanatomethyl)cyclohexane?

The molecular formula is C10H14N2O2.

What is the molecular weight of 1,3-Bis(isocyanatomethyl)cyclohexane?

The molecular weight is 194.23 g/mol.

What is the IUPAC name of 1,3-Bis(isocyanatomethyl)cyclohexane?

The IUPAC name is 1,3-bis(isocyanatomethyl)cyclohexane.

What is the InChI of 1,3-Bis(isocyanatomethyl)cyclohexane?

The InChI is InChI=1S/C10H14N2O2/c13-7-11-5-9-2-1-3-10(4-9)6-12-8-14/h9-10H,1-6H2.

What is the InChIKey of 1,3-Bis(isocyanatomethyl)cyclohexane?

The InChIKey is XSCLFFBWRKTMTE-UHFFFAOYSA-N.

What is the canonical SMILES of 1,3-Bis(isocyanatomethyl)cyclohexane?

The canonical SMILES is C1CC(CC(C1)CN=C=O)CN=C=O.

What is the CAS number of 1,3-Bis(isocyanatomethyl)cyclohexane?

The CAS number is 38661-72-2.

How many hydrogen bond donor counts are there in 1,3-Bis(isocyanatomethyl)cyclohexane?

There are 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in 1,3-Bis(isocyanatomethyl)cyclohexane?

There are 4 hydrogen bond acceptor counts.

How many rotatable bond counts are there in 1,3-Bis(isocyanatomethyl)cyclohexane?

There are 4 rotatable bond counts.