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925-78-0 | Nonan-3-one
CAS No: 925-78-0 Catalog No: AG003TA4 MDL No:MFCD00009541
Product Description
Catalog Number:
AG003TA4
Chemical Name:
Nonan-3-one
CAS Number:
925-78-0
Molecular Formula:
C9H18O
Molecular Weight:
142.2386
MDL Number:
MFCD00009541
IUPAC Name:
nonan-3-one
InChI:
InChI=1S/C9H18O/c1-3-5-6-7-8-9(10)4-2/h3-8H2,1-2H3
InChI Key:
IYTXKIXETAELAV-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)CC
EC Number:
213-125-2
UNII:
00C380UHNL
FEMA Number:
3440
Properties
Complexity:
86.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.242g/mol
Monoisotopic Mass:
142.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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