4-tert-Butylbenzoic acid vinyl ester

• CAS: 15484-80-7
• Catalog Number: ACM15484807
• Category: Polymer/Macromolecule
• Molecular Weight: 204.26g/mol
• Molecular Formula: C13H16O2
• Synonyms: 4-TERT-BUTYLBENZOIC ACID VINYL ESTER;TIMTEC-BB SBB006526;P-TERT-BUTYLBENZOIC ACID VINYL ESTER;VINYL 4-T-BUTYLBENZOATE;VINYL 4-TERT-BUTYLBENZOATE;VINYL P-TERT-BUTYLBENZOATE;Vinyltbutylbenzoate;vinyl 4-(1,1-dimethylethyl)benzoate
• IUPAC Name: ethenyl 4-tert-butylbenzoate
• Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)OC=C
• InChI: InChI=1S/C13H16O2/c1-5-15-12(14)10-6-8-11(9-7-10)13(2,3)4/h5-9H,1H2,2-4H3
• InChI Key: ZLHVSEPPILCZHH-UHFFFAOYSA-N
• Complexity: 229
• Covalently-Bonded Unit Count: 1
• EC Number: 239-510-5
• Exact Mass: 204.11503g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 15
• Monoisotopic Mass: 204.11503g/mol
• Rotatable Bond Count: 4
• XLogP3: 4.7

Custom Q&A

What is the molecular formula of 4-tert-Butylbenzoic acid vinyl ester?

The molecular formula of 4-tert-Butylbenzoic acid vinyl ester is C13H16O2.

What is the molecular weight of 4-tert-Butylbenzoic acid vinyl ester?

The molecular weight of 4-tert-Butylbenzoic acid vinyl ester is 204.26 g/mol.

What is the IUPAC name of 4-tert-Butylbenzoic acid vinyl ester?

The IUPAC name of 4-tert-Butylbenzoic acid vinyl ester is ethenyl 4-tert-butylbenzoate.

What is the InChI of 4-tert-Butylbenzoic acid vinyl ester?

The InChI of 4-tert-Butylbenzoic acid vinyl ester is InChI=1S/C13H16O2/c1-5-15-12(14)10-6-8-11(9-7-10)13(2,3)4/h5-9H,1H2,2-4H3.

What is the InChIKey of 4-tert-Butylbenzoic acid vinyl ester?

The InChIKey of 4-tert-Butylbenzoic acid vinyl ester is ZLHVSEPPILCZHH-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-tert-Butylbenzoic acid vinyl ester have?

4-tert-Butylbenzoic acid vinyl ester has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-tert-Butylbenzoic acid vinyl ester have?

4-tert-Butylbenzoic acid vinyl ester has 2 hydrogen bond acceptor counts.

What is the XLogP3 value of 4-tert-Butylbenzoic acid vinyl ester?

The XLogP3 value of 4-tert-Butylbenzoic acid vinyl ester is 4.7.

What is the exact mass of 4-tert-Butylbenzoic acid vinyl ester?

The exact mass of 4-tert-Butylbenzoic acid vinyl ester is 204.115029749 g/mol.

Is 4-tert-Butylbenzoic acid vinyl ester a canonicalized compound?

Yes, 4-tert-Butylbenzoic acid vinyl ester is a canonicalized compound.