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33693-77-5 | 2-bromo-3,3-dimethylbut-1-ene
CAS No: 33693-77-5 Catalog No: AG01EM4W MDL No:
Product Description
Catalog Number:
AG01EM4W
Chemical Name:
2-bromo-3,3-dimethylbut-1-ene
CAS Number:
33693-77-5
Molecular Formula:
C6H11Br
Molecular Weight:
163.0555
IUPAC Name:
2-bromo-3,3-dimethylbut-1-ene
InChI:
InChI=1S/C6H11Br/c1-5(7)6(2,3)4/h1H2,2-4H3
InChI Key:
XGMLKGHOPUBSND-UHFFFAOYSA-N
SMILES:
BrC(=C)C(C)(C)C
NSC Number:
246203
Properties
Complexity:
76.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.004g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.058g/mol
Monoisotopic Mass:
162.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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