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23418-38-4 | 4-Nonanol, 4-methyl-
CAS No: 23418-38-4 Catalog No: AG002N5Q MDL No:
Product Description
Catalog Number:
AG002N5Q
Chemical Name:
4-Nonanol, 4-methyl-
CAS Number:
23418-38-4
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
IUPAC Name:
4-methylnonan-4-ol
InChI:
InChI=1S/C10H22O/c1-4-6-7-9-10(3,11)8-5-2/h11H,4-9H2,1-3H3
InChI Key:
GDCOAKPWVJCNGI-UHFFFAOYSA-N
SMILES:
CCCCCC(CCC)(O)C
EC Number:
245-648-7
NSC Number:
103159
Properties
Complexity:
90.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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