Home Halogens 2-bromo-3-methylbutanal

2-bromo-3-methylbutanal

CAS No.:
64932-36-1
Catalog Number:
AG01A6EX
Molecular Formula:
C5H9BrO
Molecular Weight:
165.0284
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Product Description
Catalog Number:
AG01A6EX
Chemical Name:
2-bromo-3-methylbutanal
CAS Number:
64932-36-1
Molecular Formula:
C5H9BrO
Molecular Weight:
165.0284
MDL Number:
MFCD11846369
IUPAC Name:
2-bromo-3-methylbutanal
InChI:
InChI=1S/C5H9BrO/c1-4(2)5(6)3-7/h3-5H,1-2H3
InChI Key:
PYXPYXVGFLQQIS-UHFFFAOYSA-N
SMILES:
O=CC(C(C)C)Br
Properties
Complexity:
61.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.984g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.03g/mol
Monoisotopic Mass:
163.984g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties