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19752-21-7 | Propane, 1-bromo-2-methoxy-2-methyl-
CAS No: 19752-21-7 Catalog No: AG002AVE MDL No:MFCD08063237
Product Description
Catalog Number:
AG002AVE
Chemical Name:
Propane, 1-bromo-2-methoxy-2-methyl-
CAS Number:
19752-21-7
Molecular Formula:
C5H11BrO
Molecular Weight:
167.0442
MDL Number:
MFCD08063237
IUPAC Name:
1-bromo-2-methoxy-2-methylpropane
InChI:
InChI=1S/C5H11BrO/c1-5(2,4-6)7-3/h4H2,1-3H3
InChI Key:
NBLDQRVLOJJCCJ-UHFFFAOYSA-N
SMILES:
BrCC(OC)(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:
0
Isotope Atom Count:
0
Molecular Weight:
167.046g/mol
Monoisotopic Mass:
165.999g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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