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1-Chloro-4-ethynylbenzene

Catalog Number
ACM873734
CAS Number
873-73-4
Product Name
1-Chloro-4-ethynylbenzene
Structure
Category
Liquid Crystal (LC) Building Blocks
IUPAC Name
1-chloro-4-ethynylbenzene
Molecular Weight
136.58g/mol
Molecular Formula
C8H5Cl
Canonical SMILES
C#CC1=CC=C(C=C1)Cl
InChI
InChI=1S/C8H5Cl/c1-2-7-3-5-8(9)6-4-7/h1,3-6H
InChI Key
LFZJRTMTKGYJRS-UHFFFAOYSA-N
Complexity
123
Covalently-Bonded Unit Count
1
Exact Mass
136.007978g/mol
Formal Charge
0
Hazard Statements
H226-H315-H319-H335
Heavy Atom Count
9
Monoisotopic Mass
136.007978g/mol
Rotatable Bond Count
1
XLogP3
3.2
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