Structure

1-Bromo-2,3,5,6-tetramethylbenzene

CAS
1646-53-3
Catalog Number
ACM1646533
Category
Aryl
Molecular Weight
213.11
Molecular Formula
C10H7Br

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Specification

Hazard Statements
H302-H319
RIDADR
UN 3261 8 / PGII
Symbol
GHS07
What is the IUPAC name for 1-Bromo-2,3,5,6-tetramethylbenzene?

The IUPAC name for 1-Bromo-2,3,5,6-tetramethylbenzene is 3-bromo-1,2,4,5-tetramethylbenzene.

What is the molecular formula of 1-Bromo-2,3,5,6-tetramethylbenzene?

The molecular formula of 1-Bromo-2,3,5,6-tetramethylbenzene is C10H13Br.

What is the molecular weight of 1-Bromo-2,3,5,6-tetramethylbenzene?

The molecular weight of 1-Bromo-2,3,5,6-tetramethylbenzene is 213.11 g/mol.

What is the InChI of 1-Bromo-2,3,5,6-tetramethylbenzene?

The InChI of 1-Bromo-2,3,5,6-tetramethylbenzene is InChI=1S/C10H13Br/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,1-4H3.

What is the InChIKey of 1-Bromo-2,3,5,6-tetramethylbenzene?

The InChIKey of 1-Bromo-2,3,5,6-tetramethylbenzene is WJKBPTLQJXKEHC-UHFFFAOYSA-N.

What is the canonical SMILES representation of 1-Bromo-2,3,5,6-tetramethylbenzene?

The canonical SMILES representation of 1-Bromo-2,3,5,6-tetramethylbenzene is CC1=CC(=C(C(=C1C)Br)C)C.

What is the CAS number of 1-Bromo-2,3,5,6-tetramethylbenzene?

The CAS number of 1-Bromo-2,3,5,6-tetramethylbenzene is 1646-53-3.

What is the European Community (EC) number of 1-Bromo-2,3,5,6-tetramethylbenzene?

The European Community (EC) number of 1-Bromo-2,3,5,6-tetramethylbenzene is 216-707-4.

What is the NSC number of 1-Bromo-2,3,5,6-tetramethylbenzene?

The NSC number of 1-Bromo-2,3,5,6-tetramethylbenzene is 87881.

What is the molecular weight, XLogP3-AA, hydrogen bond donor count, hydrogen bond acceptor count, rotatable bond count, exact mass, monoisotopic mass, topological polar surface area, heavy atom count, formal charge, complexity, isotope atom count, defined atom stereocenter count, undefined atom stereocenter count, defined bond stereocenter count, undefined bond stereocenter count, covalently-bonded unit count, and compound canonicalization status of 1-Bromo-2,3,5,6-tetramethylbenzene?

The molecular weight of 1-Bromo-2,3,5,6-tetramethylbenzene is 213.11 g/mol. The XLogP3-AA is 4.1. The hydrogen bond donor count is 0. The hydrogen bond acceptor count is 0. The rotatable bond count is 0. The exact mass is 212.02006 g/mol. The monoisotopic mass is 212.02006 g/mol. The topological polar surface area is 0Ų. The heavy atom count is 11. The formal charge is 0. The complexity is 119. The isotope atom count is 0. The defined atom stereocenter count is 0. The undefined atom stereocenter count is 0. The defined bond stereocenter count is 0. The undefined bond stereocenter count is 0. The covalently-bonded unit count is 1. The compound is canonicalized.

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