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137893-83-5 | Cyclopentanone, 2-(hydroxymethyl)-2-nonyl-, (2R)-
CAS No: 137893-83-5 Catalog No: AG00141S MDL No:
Product Description
Catalog Number:
AG00141S
Chemical Name:
Cyclopentanone, 2-(hydroxymethyl)-2-nonyl-, (2R)-
CAS Number:
137893-83-5
Molecular Formula:
C15H28O2
Molecular Weight:
240.3816
IUPAC Name:
2-(hydroxymethyl)-2-nonylcyclopentan-1-one
InChI:
InChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-11-15(13-16)12-9-10-14(15)17/h16H,2-13H2,1H3
InChI Key:
ZKSYWXZTXDTILO-UHFFFAOYSA-N
SMILES:
CCCCCCCCC[C@]1(CO)CCCC1=O
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.209g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.387g/mol
Monoisotopic Mass:
240.209g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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