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113795-28-1

113795-28-1 | 1,1'-Biphenyl, 4-(3-bromopropoxy)-

CAS No: 113795-28-1 Catalog No: AG0009PB MDL No:

Product Description

Catalog Number:
AG0009PB
Chemical Name:
1,1'-Biphenyl, 4-(3-bromopropoxy)-
CAS Number:
113795-28-1
Molecular Formula:
C15H15BrO
Molecular Weight:
291.1830
IUPAC Name:
1-(3-bromopropoxy)-4-phenylbenzene
InChI:
InChI=1S/C15H15BrO/c16-11-4-12-17-15-9-7-14(8-10-15)13-5-2-1-3-6-13/h1-3,5-10H,4,11-12H2
InChI Key:
UQVMRZZSACTQPC-UHFFFAOYSA-N
SMILES:
BrCCCOc1ccc(cc1)c1ccccc1

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.031g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.188g/mol
Monoisotopic Mass:
290.031g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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