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1,4-Diethynylbenzene

Catalog Number
ACM935148-2
CAS Number
935-14-8
Product Name
1,4-Diethynylbenzene
Structure
Category
Liquid Crystal (LC) Building Blocks; Polymers
Synonyms
P-diethynyl-benzen
IUPAC Name
1,4-diethynylbenzene
Molecular Weight
126.15
Molecular Formula
C10H6
Canonical SMILES
C#CC1=CC=C(C=C1)C#C
InChI
InChI=1S/C10H6/c1-3-9-5-7-10(4-2)8-6-9/h1-2,5-8H
InChI Key
MVLGANVFCMOJHR-UHFFFAOYSA-N
Melting Point
94-98 °C-lit.
Purity
98%
Appearance
Brown powder
Complexity
163
Covalently-Bonded Unit Count
1
Exact Mass
126.04695g/mol
Formal Charge
0
Hazard Statements
H226-H315-H319-H335
Heavy Atom Count
10
MeSH Entry Terms
1,4-diethynylbenzene
Monoisotopic Mass
126.04695g/mol
Rotatable Bond Count
2
XLogP3
2.4
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