Home Other Building Blocks 3-Methyl-1-hexanol

3-Methyl-1-hexanol

CAS No.:
13231-81-7
Catalog Number:
AG0010IK
Molecular Formula:
C7H16O
Molecular Weight:
116.2013
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97.0%(GC)
1 week
United States
$206
- +
5g
>97.0%(GC)
1 week
United States
$542
- +
Product Description
Catalog Number:
AG0010IK
Chemical Name:
3-Methyl-1-hexanol
CAS Number:
13231-81-7
Molecular Formula:
C7H16O
Molecular Weight:
116.2013
MDL Number:
MFCD01321178
IUPAC Name:
3-methylhexan-1-ol
InChI:
InChI=1S/C7H16O/c1-3-4-7(2)5-6-8/h7-8H,3-6H2,1-2H3
InChI Key:
YGZVAQICDGBHMD-UHFFFAOYSA-N
SMILES:
CCCC(CCO)C
Properties
Complexity:
43.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.12g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
116.204g/mol
Monoisotopic Mass:
116.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties