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188661-36-1

188661-36-1 | 2,4-Hexadiene, 1-bromo-, (2Z,4E)-

CAS No: 188661-36-1 Catalog No: AG002H3P MDL No:

Product Description

Catalog Number:
AG002H3P
Chemical Name:
2,4-Hexadiene, 1-bromo-, (2Z,4E)-
CAS Number:
188661-36-1
Molecular Formula:
C6H9Br
Molecular Weight:
161.0397
IUPAC Name:
1-bromohexa-2,4-diene
InChI:
InChI=1S/C6H9Br/c1-2-3-4-5-6-7/h2-5H,6H2,1H3
InChI Key:
ULHCRFLCOFWWGU-UHFFFAOYSA-N
SMILES:
C/C=C/C=C\CBr

Properties

Complexity:
72.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.989g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.042g/mol
Monoisotopic Mass:
159.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
2.5  

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