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38254-49-8 | 1-Bromo-2-methyl-2-propanol
CAS No: 38254-49-8 Catalog No: AG003976 MDL No:MFCD20621218
Product Description
Catalog Number:
AG003976
Chemical Name:
1-Bromo-2-methyl-2-propanol
CAS Number:
38254-49-8
Molecular Formula:
C4H9BrO
Molecular Weight:
153.0177
MDL Number:
MFCD20621218
IUPAC Name:
1-bromo-2-methylpropan-2-ol
InChI:
InChI=1S/C4H9BrO/c1-4(2,6)3-5/h6H,3H2,1-2H3
InChI Key:
OBOTXOMQYNJWJJ-UHFFFAOYSA-N
SMILES:
BrCC(O)(C)C
Properties
Complexity:
42.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.984g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.019g/mol
Monoisotopic Mass:
151.984g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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