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113443-65-5 | Butane, 1-butoxy-1-methoxy-
CAS No: 113443-65-5 Catalog No: AG0008L6 MDL No:
Product Description
Catalog Number:
AG0008L6
Chemical Name:
Butane, 1-butoxy-1-methoxy-
CAS Number:
113443-65-5
Molecular Formula:
C9H20O2
Molecular Weight:
160.2539
IUPAC Name:
1-butoxy-1-methoxybutane
InChI:
InChI=1S/C9H20O2/c1-4-6-8-11-9(10-3)7-5-2/h9H,4-8H2,1-3H3
InChI Key:
MPAZMSQJQTWSJW-UHFFFAOYSA-N
SMILES:
CCCCOC(CCC)OC
Properties
Complexity:
74
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.146g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.257g/mol
Monoisotopic Mass:
160.146g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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