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p-n-butoxybiphenyl

CAS No.:
6842-78-0
Catalog Number:
AG0036TT
Molecular Formula:
C16H18O
Molecular Weight:
226.3135
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$782
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Product Description
Catalog Number:
AG0036TT
Chemical Name:
p-n-butoxybiphenyl
CAS Number:
6842-78-0
Molecular Formula:
C16H18O
Molecular Weight:
226.3135
MDL Number:
MFCD00445565
IUPAC Name:
1-butoxy-4-phenylbenzene
InChI:
InChI=1S/C16H18O/c1-2-3-13-17-16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-12H,2-3,13H2,1H3
InChI Key:
NCJZHZJABHDELF-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)c1ccccc1
NSC Number:
68496
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.136g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.319g/mol
Monoisotopic Mass:
226.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties