Home Halogens 3-(bromomethyl)azepan-2-one

3-(bromomethyl)azepan-2-one

CAS No.:
2092612-38-7
Catalog Number:
AG01BTR3
Molecular Formula:
C7H12BrNO
Molecular Weight:
206.0803
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Product Description
Catalog Number:
AG01BTR3
Chemical Name:
3-(bromomethyl)azepan-2-one
CAS Number:
2092612-38-7
Molecular Formula:
C7H12BrNO
Molecular Weight:
206.0803
MDL Number:
MFCD30750013
IUPAC Name:
3-(bromomethyl)azepan-2-one
InChI:
InChI=1S/C7H12BrNO/c8-5-6-3-1-2-4-9-7(6)10/h6H,1-5H2,(H,9,10)
InChI Key:
ZXVHHQWEZYZWSK-UHFFFAOYSA-N
SMILES:
BrCC1CCCCNC1=O
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.01g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.083g/mol
Monoisotopic Mass:
205.01g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties