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125552-89-8

125552-89-8 | 2H-Pyran, 4-(bromomethyl)tetrahydro-

CAS No: 125552-89-8 Catalog No: AG000NTS MDL No:MFCD03788561

Product Description

Catalog Number:
AG000NTS
Chemical Name:
2H-Pyran, 4-(bromomethyl)tetrahydro-
CAS Number:
125552-89-8
Molecular Formula:
C6H11BrO
Molecular Weight:
179.0549
MDL Number:
MFCD03788561
IUPAC Name:
4-(bromomethyl)oxane
InChI:
InChI=1S/C6H11BrO/c7-5-6-1-3-8-4-2-6/h6H,1-5H2
InChI Key:
LMOOYAKLEOGKJR-UHFFFAOYSA-N
SMILES:
BrCC1CCOCC1

Properties

Complexity:
59.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.999g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.057g/mol
Monoisotopic Mass:
177.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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