Structure

1-Allyl-2-bromobenzene

CAS
42918-20-7
Catalog Number
ACM42918207
Category
Other Products; Alcohols
Molecular Weight
197.07
Molecular Formula
C9H9Br

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Specification

Synonyms
1-Allyl-2-bromobenzene, 42918-20-7, o-Allylbromobenzene, 2-Allylbromobenzene, ACMC-20aoyl, 2-Allylphenyl bromide, 2-Bromo-1-allylbenzene, AC1LB47B, SureCN2475077, 1-bromo-2-prop-2-enylbenzene, CTK5J4022, Benzene, 1-bromo-2-(2-propenyl)-, AG-K-97869
IUPAC Name
1-bromo-2-prop-2-enylbenzene
Canonical SMILES
C=CCC1=CC=CC=C1Br
InChI Key
NTYPQDZCDDLKLV-UHFFFAOYSA-N
Exact Mass
195.98900
Hazard Statements
H226-H315-H319-H335
H-Bond Acceptor
0
H-Bond Donor
0
RIDADR
NONH for all modes of transport
Symbol
GHS02
What is the molecular formula of 1-Allyl-2-bromobenzene?

The molecular formula is C9H9Br.

What is the molecular weight of 1-Allyl-2-bromobenzene?

The molecular weight is 197.07 g/mol.

What is the IUPAC name of 1-Allyl-2-bromobenzene?

The IUPAC name is 1-bromo-2-prop-2-enylbenzene.

What is the InChI of 1-Allyl-2-bromobenzene?

The InChI is InChI=1S/C9H9Br/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7H,1,5H2.

What is the InChIKey of 1-Allyl-2-bromobenzene?

The InChIKey is NTYPQDZCDDLKLV-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Allyl-2-bromobenzene?

The canonical SMILES is C=CCC1=CC=CC=C1Br.

What is the CAS number of 1-Allyl-2-bromobenzene?

The CAS number is 42918-20-7.

What is the EC number of 1-Allyl-2-bromobenzene?

The EC number is 662-903-1.

What is the DSSTox Substance ID of 1-Allyl-2-bromobenzene?

The DSSTox Substance ID is DTXSID90341833.

Is 1-Allyl-2-bromobenzene canonicalized?

Yes, it is canonicalized.

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