Home Other Building Blocks 1-methoxy-4,4-dimethylpentan-3-ol

1-methoxy-4,4-dimethylpentan-3-ol

CAS No.:
1249800-80-3
Catalog Number:
AG01B8Z4
Molecular Formula:
C8H18O2
Molecular Weight:
146.2273
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Product Description
Catalog Number:
AG01B8Z4
Chemical Name:
1-methoxy-4,4-dimethylpentan-3-ol
CAS Number:
1249800-80-3
Molecular Formula:
C8H18O2
Molecular Weight:
146.2273
MDL Number:
MFCD16807936
IUPAC Name:
1-methoxy-4,4-dimethylpentan-3-ol
InChI:
InChI=1S/C8H18O2/c1-8(2,3)7(9)5-6-10-4/h7,9H,5-6H2,1-4H3
InChI Key:
NRNDHUQEQIUWIU-UHFFFAOYSA-N
SMILES:
COCCC(C(C)(C)C)O
Properties
Complexity:
83.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.131g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.23g/mol
Monoisotopic Mass:
146.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties