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141135-34-4 | Benzene, 1,4-bis(4-chloro-3-buten-1-yn-1-yl)-
CAS No: 141135-34-4 Catalog No: AG001FZE MDL No:
Product Description
Catalog Number:
AG001FZE
Chemical Name:
Benzene, 1,4-bis(4-chloro-3-buten-1-yn-1-yl)-
CAS Number:
141135-34-4
Molecular Formula:
C14H8Cl2
Molecular Weight:
247.1193
IUPAC Name:
1,4-bis(4-chlorobut-3-en-1-ynyl)benzene
InChI:
InChI=1S/C14H8Cl2/c15-11-3-1-5-13-7-9-14(10-8-13)6-2-4-12-16/h3-4,7-12H
InChI Key:
WLNMGGHFINLQHG-UHFFFAOYSA-N
SMILES:
ClC=CC#Cc1ccc(cc1)C#CC=CCl
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.118g/mol
Monoisotopic Mass:
246g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.8
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