1-(4-Bromophenyl)hexane

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Catalog Number

ACM23703222

Product Name

Structure

CAS

23703-22-2

Category

Heterocyclic Organic Compound

IUPAC Name

1-bromo-4-hexylbenzene

Molecular Weight

241.17g/mol

Molecular Formula

C12H17Br

Canonical SMILES

CCCCCCC1=CC=C(C=C1)Br

InChI

InChI=1S/C12H17Br/c1-2-3-4-5-6-11-7-9-12(13)10-8-11/h7-10H,2-6H2,1H3

InChI Key

MXHOLIARBWJKCR-UHFFFAOYSA-N

Complexity

114

Covalently-Bonded Unit Count

Exact Mass

240.05136g/mol

Formal Charge

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

240.05136g/mol

Rotatable Bond Count

XLogP3

5.3

MSDS

COA

Spec Sheet

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