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89045-03-4 | Pentane, 2-methoxy-2,4-dimethyl-
CAS No: 89045-03-4 Catalog No: AG0043B0 MDL No:
Product Description
Catalog Number:
AG0043B0
Chemical Name:
Pentane, 2-methoxy-2,4-dimethyl-
CAS Number:
89045-03-4
Molecular Formula:
C8H18O
Molecular Weight:
130.2279
IUPAC Name:
2-methoxy-2,4-dimethylpentane
InChI:
InChI=1S/C8H18O/c1-7(2)6-8(3,4)9-5/h7H,6H2,1-5H3
InChI Key:
YRSWRMLCSAFQSX-UHFFFAOYSA-N
SMILES:
COC(CC(C)C)(C)C
Properties
Complexity:
74.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.136g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.231g/mol
Monoisotopic Mass:
130.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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