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28569-48-4

28569-48-4 | Thiophene, 2,5-bis(chloromethyl)-

CAS No: 28569-48-4 Catalog No: AG002VQC MDL No:

Product Description

Catalog Number:
AG002VQC
Chemical Name:
Thiophene, 2,5-bis(chloromethyl)-
CAS Number:
28569-48-4
Molecular Formula:
C6H6Cl2S
Molecular Weight:
181.0828
IUPAC Name:
2,5-bis(chloromethyl)thiophene
InChI:
InChI=1S/C6H6Cl2S/c7-3-5-1-2-6(4-8)9-5/h1-2H,3-4H2
InChI Key:
OJBWNBCXVFAMEX-UHFFFAOYSA-N
SMILES:
ClCc1ccc(s1)CCl

Properties

Complexity:
77.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.957g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.074g/mol
Monoisotopic Mass:
179.957g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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