Nonane, glass distilled

CAT: 0127-SV1086Size: 1 EachDry Ice: NoHazardous: No

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CAT#:0127-SV1086Size:1 Each

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CAS Number

111-84-2

MDL Number

MFCD00009574

Smiles

CCCCCCCCC

Chemical Information

Nonane

Nonane is a straight chain alkane composed of 9 carbon atoms. It has a role as a volatile oil component and a plant metabolite.

CAS Number	111-84-2
PubChem CID	8141
IUPAC Name	nonane
Molecular Formula	C9H20
Molecular Weight	128.25
XLogP	4.5
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	6
Heavy Atom Count	9
Formal Charge	0
Complexity	33

SMILES

CCCCCCCCC

InChI

InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3

InChIKey

BKIMMITUMNQMOS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 111-84-2

CID: 8141

Formula: C9H20

MW: 128.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.25
XLogP3	4.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	6
Exact Mass	128.156500638
Monoisotopic Mass	128.156500638
Topological Polar Surface Area	0 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	33.3
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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