Home Halogens 1-bromo-3-(oxolan-2-yl)propan-2-one

1-bromo-3-(oxolan-2-yl)propan-2-one

CAS No.:
1538694-77-7
Catalog Number:
AG01C1Q9
Molecular Formula:
C7H11BrO2
Molecular Weight:
207.0650
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Product Description
Catalog Number:
AG01C1Q9
Chemical Name:
1-bromo-3-(oxolan-2-yl)propan-2-one
CAS Number:
1538694-77-7
Molecular Formula:
C7H11BrO2
Molecular Weight:
207.0650
MDL Number:
MFCD23845057
IUPAC Name:
1-bromo-3-(oxolan-2-yl)propan-2-one
InChI:
InChI=1S/C7H11BrO2/c8-5-6(9)4-7-2-1-3-10-7/h7H,1-5H2
InChI Key:
KNVPYQQFSYYYAW-UHFFFAOYSA-N
SMILES:
BrCC(=O)CC1CCCO1
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.994g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.067g/mol
Monoisotopic Mass:
205.994g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties