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123402-45-9 | 1-Nonanol, 4-methyl-, (4R)-
CAS No: 123402-45-9 Catalog No: AG000KJF MDL No:
Product Description
Catalog Number:
AG000KJF
Chemical Name:
1-Nonanol, 4-methyl-, (4R)-
CAS Number:
123402-45-9
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
IUPAC Name:
(4R)-4-methylnonan-1-ol
InChI:
InChI=1S/C10H22O/c1-3-4-5-7-10(2)8-6-9-11/h10-11H,3-9H2,1-2H3/t10-/m1/s1
InChI Key:
HECVGHIJHFNAIL-SNVBAGLBSA-N
SMILES:
CCCCC[C@H](CCCO)C
Properties
Complexity:
71.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
158.167g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.285g/mol
Monoisotopic Mass:
158.167g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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