Propiolic acid

CAT: 0926-FP07024-02Size: 0.1 KgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FP07024-02Size:0.1 Kg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

471-25-0

Synonyms

Acetylenecarboxylic acid; Propargylic acid

MDL Number

MFCD00004360

Smiles

C#CC (=O) O

Molecular Formula

C3H2O2

Molecular Weight

70.05 g/mol

Controlled

Chemical Information

Propiolic Acid

Propynoic acid is a terminal acetylenic compound that is a 3-carbon, straight-chain, monounsaturated fatty acid having one acetylenic bond. It has a role as a xenobiotic metabolite. It is an acetylenic fatty acid, a monounsaturated fatty acid, a short-chain fatty acid, a terminal acetylenic compound and an alpha,beta-unsaturated monocarboxylic acid. It is a conjugate acid of a propynoate.

CAS Number	471-25-0
PubChem CID	10110
IUPAC Name	prop-2-ynoic acid
Molecular Formula	C3H2O2
Molecular Weight	70.05
XLogP	0.3
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	5
Formal Charge	0
Complexity	84

SMILES

C#CC(=O)O

InChI

InChI=1S/C3H2O2/c1-2-3(4)5/h1H,(H,4,5)

InChIKey

UORVCLMRJXCDCP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 471-25-0

CID: 10110

Formula: C3H2O2

MW: 70.05

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	70.05
XLogP3	0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	70.005479302
Monoisotopic Mass	70.005479302
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	84.3
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

Related Products

Catalog	Name
FD02504-01	Dimethylol propionic acid
DDA75136-01	2- (Thiobenzoylthio) propionic acid
FP26884-01	Phenothiazine-10-propionic acid
FT29777-01	3- (Tritylthio) propionic acid
FM172706-01	3- (Methylphosphinico) propionic acid
FA70180-01	β- (4-Acetoxyphenyl) propionic acid
FI30477-01	Indole-3-propionic acid
FAA65238	3-Phenylamino-propionic acid
FA66543-01	β- (3-Aminophenyl) propionic acid
FP73007-01	Amino-PEG4-propionic acid

Alternative Products

Catalog	Name
286462-01	Propiolic acid
N2605	(4-Nitrophenyl) propiolic Acid
MBS6066968-01	(4-Nitrophenyl)propiolic Acid
sc-394060	Propiolic Acid Sodium Salt
OR96846-01	3- (Trimethylsilyl) propiolic acid
OR1058579-01	3- (Triethylsilyl) propiolic acid
OR1100405	3- (2-Bromophenyl) propiolic acid
TRC-P786332-10MG	Propiolic Acid-13C3 Sodium Salt
TRC-P786330-500MG	Propiolic Acid Sodium Salt (90%)
OR92804-01	3- (3-Bromophenyl) propiolic acid

Propiolic acid

Chemical Information

Related Products

Alternative Products

Popular Products