Home Other Building Blocks 3-[(1,1-Dimethylethoxy)methyl]heptane

3-[(1,1-Dimethylethoxy)methyl]heptane

CAS No.:
83704-03-4
Catalog Number:
AG0036HP
Molecular Formula:
C12H26O
Molecular Weight:
186.3342
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$523
- +
250mg
95%
In Stock USA
United States
$782
- +
Product Description
Catalog Number:
AG0036HP
Chemical Name:
3-[(1,1-Dimethylethoxy)methyl]heptane
CAS Number:
83704-03-4
Molecular Formula:
C12H26O
Molecular Weight:
186.3342
MDL Number:
MFCD31568162
IUPAC Name:
3-[(2-methylpropan-2-yl)oxymethyl]heptane
InChI:
InChI=1S/C12H26O/c1-6-8-9-11(7-2)10-13-12(3,4)5/h11H,6-10H2,1-5H3
InChI Key:
JATPQYIRMHQKTK-UHFFFAOYSA-N
SMILES:
CCCCC(COC(C)(C)C)CC
EC Number:
280-522-5
Properties
Complexity:
113  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.198g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.339g/mol
Monoisotopic Mass:
186.198g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties