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1155511-07-1

1155511-07-1 | 2H-Pyran, 2-[(3-bromophenoxy)methyl]tetrahydro-

CAS No: 1155511-07-1 Catalog No: AG000G50 MDL No:MFCD12641995

Product Description

Catalog Number:
AG000G50
Chemical Name:
2H-Pyran, 2-[(3-bromophenoxy)methyl]tetrahydro-
CAS Number:
1155511-07-1
Molecular Formula:
C12H15BrO2
Molecular Weight:
271.1503
MDL Number:
MFCD12641995
IUPAC Name:
2-[(3-bromophenoxy)methyl]oxane
InChI:
InChI=1S/C12H15BrO2/c13-10-4-3-6-11(8-10)15-9-12-5-1-2-7-14-12/h3-4,6,8,12H,1-2,5,7,9H2
InChI Key:
OJTWPHANYWJFSY-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)OCC1CCCCO1

Properties

Complexity:
187  
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:
3  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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