Home Other Building Blocks 1-methoxypentan-3-ol

1-methoxypentan-3-ol

CAS No.:
27999-99-1
Catalog Number:
AG01A2I3
Molecular Formula:
C6H14O2
Molecular Weight:
118.1742
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Product Description
Catalog Number:
AG01A2I3
Chemical Name:
1-methoxypentan-3-ol
CAS Number:
27999-99-1
Molecular Formula:
C6H14O2
Molecular Weight:
118.1742
MDL Number:
MFCD14661443
IUPAC Name:
1-methoxypentan-3-ol
InChI:
InChI=1S/C6H14O2/c1-3-6(7)4-5-8-2/h6-7H,3-5H2,1-2H3
InChI Key:
AZMRGYLVBHEDEZ-UHFFFAOYSA-N
SMILES:
COCCC(CC)O
Properties
Complexity:
45.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.099g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
118.176g/mol
Monoisotopic Mass:
118.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties