(R) - (+) -2-Acetoxypropionic acid

CAT: 0127-OR91333-01Size: 1 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR91333-01Size:1 g

Selected

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

Quick Request Actions

CAS Number

18668-00-3

MDL Number

MFCD16036178

Purity

98%

Smiles

O=C(O)[C@@H](C)OC(C)=O

Chemical Information

(R)-(+)-2-Acetoxypropionic Acid

CAS Number	18668-00-3
PubChem CID	5325906
IUPAC Name	(2R)-2-acetyloxypropanoic acid
Molecular Formula	C5H8O4
Molecular Weight	132.11
XLogP	0.1
Topological Polar Surface Area	63.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	9
Formal Charge	0
Complexity	129

SMILES

C[C@H](C(=O)O)OC(=O)C

InChI

InChI=1S/C5H8O4/c1-3(5(7)8)9-4(2)6/h3H,1-2H3,(H,7,8)/t3-/m1/s1

InChIKey

WTLNOANVTIKPEE-GSVOUGTGSA-N

Chemical Structure

2D Structure

CAS: 18668-00-3

CID: 5325906

Formula: C5H8O4

MW: 132.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	132.11
XLogP3	0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	132.04225873
Monoisotopic Mass	132.04225873
Topological Polar Surface Area	63.6 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	129
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR322114-01	(S) - (-) -2-Acetoxypropionic acid
OR307022	(R, R) -2-Carbamoylcyclohexanecarboxylic acid
OR1067356-01	2-Acetoxypropanoic acid
OR1040491-01	(R) -2-bromosuccinic acid
OR1073992-01	(R) -2-Propyloctanoic acid
OR1026042-01	(R) -2-Benzylsuccinic Acid
OR302445-01	(R) -2-Methoxypropanoic acid
OR304087-01	(R) - (-) -2-Phenylbutyric acid
OR315005-01	(R) - (-) -2-Chloromandelic acid
OR1046874-01	(R) -2-Hydroxypentanoic acid

Catalog	Name
sc-223356	(±) -2-Acetoxypropionic acid
sc-258103	(S) - (-) -2-Acetoxypropionic acid
D3727-70	2,2-Diphenylpentanoic Acid (2,2-Diphenylvaleric Acid)
MBS6054549-01	2-Mercaptophenylacetic Acid (2-Mercaptobenzeneacetic Acid)
TRC-N345640-5G	2-Naphthoic Acid (2-Naphthalenecarboxylic Acid)
A0536-45	2-Acetylthioisobutyric Acid ((2-Acetylthio) -2-methylpropanoic Acid)
MBS6023740-01	2-Acetylthioisobutyric Acid ((2-Acetylthio)-2-methylpropanoic Acid)
AR-V01417-01	Vildagliptin carboxylic acid 2,2,2-trifluoroacetic acid
14633379-250g	Homophthalic acid (2-Carboxyphenylacetic acid)
214461	2-Propylvaleric Acid (Valproic Acid)