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2-Nonyn-1-ol

CAT: 0572-TRC-N650400-10GSize: 10 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-N650400-10GSize:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5921-73-3
Synonyms
1-Hydroxy-2-nonyne
Hazard Statement
Flammable liquid and vapour; UN number: UN1987; Packing Group: III
Smiles
CCCCCCC#CCO
Molecular Formula
C9H16O
Molecular Weight
140.22
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Non-2-yn-1-ol
CAS Number5921-73-3
PubChem CID80017
IUPAC Namenon-2-yn-1-ol
Molecular FormulaC9H16O
Molecular Weight140.22
XLogP2.8
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count10
Formal Charge0
Complexity115
SMILES
CCCCCCC#CCO
InChI
InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h10H,2-6,9H2,1H3
InChIKey
XERDOEKKHDALKJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Non-2-yn-1-ol
CAS: 5921-73-3
CID: 80017
Formula: C9H16O
MW: 140.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight140.22
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass140.120115130
Monoisotopic Mass140.120115130
Topological Polar Surface Area20.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity115
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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