Propargyl alcohol

CAT: 0024-sc-224210ASize: 500 mLDry Ice: NoHazardous: No

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CAS Number

107-19-7

Chemical Information

Propargyl alcohol

Prop-2-yn-1-ol is a terminal acetylenic compound that is prop-2-yne substituted by a hydroxy group at position 1. It has a role as an antifungal agent and a Saccharomyces cerevisiae metabolite. It is a volatile organic compound, a propynol and a terminal acetylenic compound.

CAS Number	107-19-7
PubChem CID	7859
IUPAC Name	prop-2-yn-1-ol
Molecular Formula	C3H4O
Molecular Weight	56.06
XLogP	-0.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	4
Formal Charge	0
Complexity	38

SMILES

C#CCO

InChI

InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2

InChIKey

TVDSBUOJIPERQY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 107-19-7

CID: 7859

Formula: C3H4O

MW: 56.06

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	56.06
XLogP3	-0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	56.026214747
Monoisotopic Mass	56.026214747
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	4
Formal Charge	0
Complexity	38.5
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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T24666	Propargyl-PEG14-alcohol
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HY-138366	Propargyl-PEG11-alcohol
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BIPG1717-01	Propargyl-PEG8-alcohol

Propargyl alcohol

Chemical Information

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