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136707-95-4 | 2-Octen-4-ol, 3-methyl-, (2E)-
CAS No: 136707-95-4 Catalog No: AG00129A MDL No:
Product Description
Catalog Number:
AG00129A
Chemical Name:
2-Octen-4-ol, 3-methyl-, (2E)-
CAS Number:
136707-95-4
Molecular Formula:
C9H18O
Molecular Weight:
142.2386
IUPAC Name:
3-methyloct-2-en-4-ol
InChI:
InChI=1S/C9H18O/c1-4-6-7-9(10)8(3)5-2/h5,9-10H,4,6-7H2,1-3H3
InChI Key:
XRVYDGOUESSMCD-UHFFFAOYSA-N
SMILES:
CCCCC(/C(=C/C)/C)O
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.242g/mol
Monoisotopic Mass:
142.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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