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85163-13-9 | Cyclopentanone, 3-pentyl-
CAS No: 85163-13-9 Catalog No: AG004QP3 MDL No:
Product Description
Catalog Number:
AG004QP3
Chemical Name:
Cyclopentanone, 3-pentyl-
CAS Number:
85163-13-9
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
IUPAC Name:
3-pentylcyclopentan-1-one
InChI:
InChI=1S/C10H18O/c1-2-3-4-5-9-6-7-10(11)8-9/h9H,2-8H2,1H3
InChI Key:
GWSPTFQZKGLWES-UHFFFAOYSA-N
SMILES:
CCCCCC1CCC(=O)C1
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
0
Isotope Atom Count:
0
Molecular Weight:
154.253g/mol
Monoisotopic Mass:
154.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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