Ethyl 2-methyl-2,3-butadienoate

• CAS: 5717-41-9
• Catalog Number: ACM5717419
• Category: Other Products; Alkenes
• Molecular Weight: 126.15
• Molecular Formula: C7H10O2
• Synonyms: 5717-41-9, CTK1F2739, Ethyl 2-methyl-2,3-butadienoate, Ethyl 1-methylallene-1-carboxylate, Ethyl 2,3-butadiene-2-carboxylate, 2-Methyl-2,3-butadienoic acid ethyl ester, 2,3-Butadienoic acid, 2-methyl-, ethyl ester
• IUPAC Name: ethyl 2-methylbuta-2,3-dienoate
• Canonical SMILES: CCOC(=O)C(=C=C)C
• InChI Key: QFTBEYHBIFWGHJ-UHFFFAOYSA-N
• Exact Mass: 126.06800
• Hazard Statements: H225
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• RIDADR: UN3082 - class 9 - PG 3 - DOT NA1993 - Environmentally hazardous substances, liquid, n.o.s. HI: all (not BR)
• Symbol: GHS02

Custom Q&A

What is the molecular formula of Ethyl 2-methyl-2,3-butadienoate?

The molecular formula of Ethyl 2-methyl-2,3-butadienoate is C7H10O2.

What is the molecular weight of Ethyl 2-methyl-2,3-butadienoate?

The molecular weight of Ethyl 2-methyl-2,3-butadienoate is 126.15 g/mol.

What is the InChI of Ethyl 2-methyl-2,3-butadienoate?

The InChI of Ethyl 2-methyl-2,3-butadienoate is InChI=1S/C7H10O2/c1-4-6(3)7(8)9-5-2/h1,5H2,2-3H3.

What is the InChIKey of Ethyl 2-methyl-2,3-butadienoate?

The InChIKey of Ethyl 2-methyl-2,3-butadienoate is QFTBEYHBIFWGHJ-UHFFFAOYSA-N.

What is the CAS number of Ethyl 2-methyl-2,3-butadienoate?

The CAS number of Ethyl 2-methyl-2,3-butadienoate is 5717-41-9.

What is the XLogP3-AA value of Ethyl 2-methyl-2,3-butadienoate?

The XLogP3-AA value of Ethyl 2-methyl-2,3-butadienoate is 1.

How many hydrogen bond donor counts does Ethyl 2-methyl-2,3-butadienoate have?

Ethyl 2-methyl-2,3-butadienoate has zero hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Ethyl 2-methyl-2,3-butadienoate have?

Ethyl 2-methyl-2,3-butadienoate has two hydrogen bond acceptor counts.

How many rotatable bond counts does Ethyl 2-methyl-2,3-butadienoate have?

Ethyl 2-methyl-2,3-butadienoate has three rotatable bond counts.

What is the topological polar surface area of Ethyl 2-methyl-2,3-butadienoate?

The topological polar surface area of Ethyl 2-methyl-2,3-butadienoate is 26.3 Ų.