Home Other Building Blocks 1-methoxy-4-methylpentan-2-ol

1-methoxy-4-methylpentan-2-ol

CAS No.:
53892-33-4
Catalog Number:
AG01AGMA
Molecular Formula:
C7H16O2
Molecular Weight:
132.2007
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Product Description
Catalog Number:
AG01AGMA
Chemical Name:
1-methoxy-4-methylpentan-2-ol
CAS Number:
53892-33-4
Molecular Formula:
C7H16O2
Molecular Weight:
132.2007
MDL Number:
MFCD14691027
IUPAC Name:
1-methoxy-4-methylpentan-2-ol
InChI:
InChI=1S/C7H16O2/c1-6(2)4-7(8)5-9-3/h6-8H,4-5H2,1-3H3
InChI Key:
PUBJOYLZVVHMIK-UHFFFAOYSA-N
SMILES:
COCC(CC(C)C)O
Properties
Complexity:
61.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.115g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
132.203g/mol
Monoisotopic Mass:
132.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties