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71777-34-9 | 1-Dodecanol, 10-methyl-, acetate, (R)-
CAS No: 71777-34-9 Catalog No: AG005FLQ MDL No:
Product Description
Catalog Number:
AG005FLQ
Chemical Name:
1-Dodecanol, 10-methyl-, acetate, (R)-
CAS Number:
71777-34-9
Molecular Formula:
C15H32O3
Molecular Weight:
260.4128
IUPAC Name:
acetic acid;(10R)-10-methyldodecan-1-ol
InChI:
InChI=1S/C13H28O.C2H4O2/c1-3-13(2)11-9-7-5-4-6-8-10-12-14;1-2(3)4/h13-14H,3-12H2,1-2H3;1H3,(H,3,4)/t13-;/m1./s1
InChI Key:
LRYHQMDCEIJFJX-BTQNPOSSSA-N
SMILES:
CC(=O)O.OCCCCCCCCC[C@@H](CC)C
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
260.235g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.418g/mol
Monoisotopic Mass:
260.235g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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