Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate

• CAS: 6203-08-3
• Catalog Number: ACM6203083
• Category: Polymer/Macromolecule
• Molecular Weight: 152.19g/mol
• Molecular Formula: C9H12O2
• Synonyms: METHYL 8,9,10-TRINORBORNA-5-ENE-2-CARBOXYLATE;METHYL BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLATE;METHYL 5-NORBORNENE-2-CARBOXYLATE;BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID METHYL ESTER;8,9,10-TRINORBORNA-5-ENE-2-CARBOXYLIC ACID METHYL ESTER;5-NORBORNENE-2-CA
• IUPAC Name: methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate
• Canonical SMILES: COC(=O)C1CC2CC1C=C2
• InChI: InChI=1S/C9H12O2/c1-11-9(10)8-5-6-2-3-7(8)4-6/h2-3,6-8H,4-5H2,1H3
• InChI Key: RMAZRAQKPTXZNL-UHFFFAOYSA-N
• Complexity: 208
• Covalently-Bonded Unit Count: 1
• Exact Mass: 152.08373g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 11
• Monoisotopic Mass: 152.08373g/mol
• NSC Number: 69065
• Rotatable Bond Count: 2
• XLogP3: 1.5

Custom Q&A

What is the molecular formula of Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate?

The molecular formula is C9H12O2.

What are some synonyms for Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate?

Some synonyms include Methyl 5-norbornene-2-carboxylate and Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, methyl ester.

When was Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate created on PubChem?

It was created on March 26, 2005.

What is the InChI key for Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate?

The InChI key is RMAZRAQKPTXZNL-UHFFFAOYSA-N.

How many hydrogen bond acceptors does Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate have?

It has 2 hydrogen bond acceptors.

What is the topological polar surface area of Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate?

The topological polar surface area is 26.3Ų.

How many defined atom stereocenters does Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate have?

It has 0 defined atom stereocenters.

What is the XLogP3-AA value of Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate?

The XLogP3-AA value is 1.5.

What is the molecular weight of Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate?

The molecular weight is 152.19 g/mol.

Is Methyl bicyclo[2.2.1]hept-5-ene-2-carboxylate identified as a canonicalized compound on PubChem?

Yes, the compound is canonicalized on PubChem.