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Home Other Building Blocks 3-METHYL-1-PENTEN-3-OL

3-METHYL-1-PENTEN-3-OL

CAS No.:
918-85-4
Catalog Number:
AG003JOS
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$142
- +
5g
1 week
United States
$324
- +
10g
1 week
United States
$567
- +
Product Description
Catalog Number:
AG003JOS
Chemical Name:
3-METHYL-1-PENTEN-3-OL
CAS Number:
918-85-4
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
MDL Number:
MFCD03427175
IUPAC Name:
3-methylpent-1-en-3-ol
InChI:
InChI=1S/C6H12O/c1-4-6(3,7)5-2/h4,7H,1,5H2,2-3H3
InChI Key:
HFYAEUXHCMTPOL-UHFFFAOYSA-N
SMILES:
CC(C=C)(CC)O
EC Number:
213-044-2
NSC Number:
128156
Properties
Complexity:
68.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.089g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
100.161g/mol
Monoisotopic Mass:
100.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Studies of the gas phase reactions of linalool, 6-methyl-5-hepten-2-ol and 3-methyl-1-penten-3-ol with O3 and OH radicals. The journal of physical chemistry. A 20120621
Selective hydrogenation by Pd nanoparticles embedded in polyelectrolyte multilayers. Journal of the American Chemical Society 20040310
Properties