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210036-31-0 | 1,5-Nonadien-4-ol, 3-methyl-, (3S,4S,5E)-
CAS No: 210036-31-0 Catalog No: AG002KIX MDL No:
Product Description
Catalog Number:
AG002KIX
Chemical Name:
1,5-Nonadien-4-ol, 3-methyl-, (3S,4S,5E)-
CAS Number:
210036-31-0
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
(3S,4S)-3-methylnona-1,5-dien-4-ol
InChI:
InChI=1S/C10H18O/c1-4-6-7-8-10(11)9(3)5-2/h5,7-11H,2,4,6H2,1,3H3/t9-,10-/m0/s1
InChI Key:
XRKYXUAJVIKWKG-UWVGGRQHSA-N
SMILES:
C[C@H]([C@H](/C=C/CCC)O)C=C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
154.136g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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