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35979-69-2 | 4-Bromo-2-methylbutan-2-ol
CAS No: 35979-69-2 Catalog No: AG0037ZX MDL No:MFCD20483824
Product Description
Catalog Number:
AG0037ZX
Chemical Name:
4-Bromo-2-methylbutan-2-ol
CAS Number:
35979-69-2
Molecular Formula:
C5H11BrO
Molecular Weight:
167.0442
MDL Number:
MFCD20483824
IUPAC Name:
4-bromo-2-methylbutan-2-ol
InChI:
InChI=1S/C5H11BrO/c1-5(2,7)3-4-6/h7H,3-4H2,1-2H3
InChI Key:
RBFVGQWGOARJRU-UHFFFAOYSA-N
SMILES:
BrCCC(O)(C)C
Properties
Complexity:
52
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:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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