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2588-77-4 | 2-Methyl-3-bromo-2-butanol
CAS No: 2588-77-4 Catalog No: AG0037HJ MDL No:
Product Description
Catalog Number:
AG0037HJ
Chemical Name:
2-Methyl-3-bromo-2-butanol
CAS Number:
2588-77-4
Molecular Formula:
C5H11BrO
Molecular Weight:
167.0442
IUPAC Name:
3-bromo-2-methylbutan-2-ol
InChI:
InChI=1S/C5H11BrO/c1-4(6)5(2,3)7/h4,7H,1-3H3
InChI Key:
YGHWXEJVGBPVSX-UHFFFAOYSA-N
SMILES:
CC(C(O)(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:
165.999g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.046g/mol
Monoisotopic Mass:
165.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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