N-Decanophenone

CAT: 0127-OR1043083-04Size: 500 gDry Ice: NoHazardous: No

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CAT#:0127-OR1043083-04Size:500 g

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CAS Number

6048-82-4

Purity

98%

Smiles

CCCCCCCCCC(=O)c1ccccc1

Chemical Information

1-Phenyl-1-decanone

CAS Number	6048-82-4
PubChem CID	80148
IUPAC Name	1-phenyldecan-1-one
Molecular Formula	C16H24O
Molecular Weight	232.36
XLogP	5.7
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Heavy Atom Count	17
Formal Charge	0
Complexity	192

SMILES

CCCCCCCCCC(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H24O/c1-2-3-4-5-6-7-11-14-16(17)15-12-9-8-10-13-15/h8-10,12-13H,2-7,11,14H2,1H3

InChIKey

QQXJNLYVPPBERR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6048-82-4

CID: 80148

Formula: C16H24O

MW: 232.36

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	232.36
XLogP3	5.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Exact Mass	232.182715385
Monoisotopic Mass	232.182715385
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	192
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
MBS5780968	Decanophenone, 10-fluoro-
OH153454-01	N, N', N'', N''', N'''', N''''', N''''''-Heptaacetylchitoheptaose
FH171463-01	N, N, N', N', N'', N''-Hexamethoxymethylmelamine
sc-222018B	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
TRC-H290750-10MG	N,N’,N’’,N’’’,N’’’’,N’’’’’-Hexaacetylchitohexaose
AR-O01213-01	N, N’, N’’, N’’’, N’’’’, N’’’’’-Hexaacetylchitohexaose
TRC-P225000-100MG	N,N’,N’’,N’’’,N’’’’-Pentaacetylchitopentaose
sc-255378	N, N, N', N'', N''-Pentamethyldiethylenetriamine
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T03960-01	N, N, N', N'-Tetraethylethylenediamine