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82391-01-3

82391-01-3 | 2H-Pyran, 2-(3-bromophenoxy)tetrahydro-2-methyl-

CAS No: 82391-01-3 Catalog No: AG004WZJ MDL No:

Product Description

Catalog Number:
AG004WZJ
Chemical Name:
2H-Pyran, 2-(3-bromophenoxy)tetrahydro-2-methyl-
CAS Number:
82391-01-3
Molecular Formula:
C12H15BrO2
Molecular Weight:
271.1503
IUPAC Name:
2-(3-bromophenoxy)-2-methyloxane
InChI:
InChI=1S/C12H15BrO2/c1-12(7-2-3-8-14-12)15-11-6-4-5-10(13)9-11/h4-6,9H,2-3,7-8H2,1H3
InChI Key:
MCWWGORDPWCXCY-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)OC1(C)CCCCO1

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.026g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.154g/mol
Monoisotopic Mass:
270.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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