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1856583-78-2

1856583-78-2 | 2-(bromomethyl)-7-oxabicyclo[2.2.1]heptane

CAS No: 1856583-78-2 Catalog No: AG01AUTA MDL No:MFCD24530652

Product Description

Catalog Number:
AG01AUTA
Chemical Name:
2-(bromomethyl)-7-oxabicyclo[2.2.1]heptane
CAS Number:
1856583-78-2
Molecular Formula:
C7H11BrO
Molecular Weight:
191.0656
MDL Number:
MFCD24530652
IUPAC Name:
2-(bromomethyl)-7-oxabicyclo[2.2.1]heptane
InChI:
InChI=1S/C7H11BrO/c8-4-5-3-6-1-2-7(5)9-6/h5-7H,1-4H2
InChI Key:
UHZMGDQVYYPBQQ-UHFFFAOYSA-N
SMILES:
BrCC1CC2OC1CC2

Properties

Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.999g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.068g/mol
Monoisotopic Mass:
189.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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